CAS: 1191997-63-3
이름: methyl (2S)-2-[3-(2-chlorophenoxy)-5-oxo-2H-pyrrol-1-yl]-4-methylpentanoate
SMILES:
CC(C)CC(C(=O)OC)N1CC(=CC1=O)OC2=CC=CC=C2ClMolecular Processing
Molecular formula
C17H20ClNO4
Molecular weight
337.8
Exact mass
337.1081
XLogP
3.03
TPSA
55.84
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
87.14
Supplementary Information
InChIKey: BMVAWDBPBCLLQQ-AWEZNQCLSA-N
동의어
1191997-63-3(S)-methyl 2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylpentanoatemethyl (2S)-2-[3-(2-chlorophenoxy)-5-oxo-2H-pyrrol-1-yl]-4-methylpentanoate1H-Pyrrole-1-acetic acid, 4-(2-chlorophenoxy)-2,5-dihydro-alpha-(2-methylpropyl)-2-oxo-, methyl ester, (alphaS)-SCHEMBL1064483DTXSID10721315BMVAWDBPBCLLQQ-AWEZNQCLSA-NAKOS015995077(S)-2-[4-(2-chloro-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-4-methyl-pentanoic acid methyl esterDB-353679(S)-methyl-2-(4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1h-pyrrol-1-yl)-4-methylpentan oateMethyl (2S)-2-[4-(2-chlorophenoxy)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methylpentanoate
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