COC(=O)C1CC(=C)CN1C(=O)OCC2=CC=CC=C2
الاسم: 1-O-benzyl 2-O-methyl 4-methylidenepyrrolidine-1,2-dicarboxylate
SMILES: COC(=O)C1CC(=C)CN1C(=O)OCC2=CC=CC=C2

Molecular Processing

Molecular formula
C15H17NO4
Molecular weight
275.3
Exact mass
275.1158
XLogP
2.13
TPSA
55.84
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
72.89

Supplementary Information

InChIKey: PHWGPICRKIRWAG-UHFFFAOYSA-N
مرادفات
SCHEMBL202453PHWGPICRKIRWAG-UHFFFAOYSA-NAB92121O1-benzyl O2-methyl 4-methylenepyrrolidine-1,2-dicarboxylate4-methylene-pyrrolidine-1,2-dicarboxylic acid 1-benzyl ester 2-methyl ester
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