COC(=O)CCCCCOC1=CC=C(C=C1)NC(=O)OCCO
Name: methyl 6-[4-(2-hydroxyethoxycarbonylamino)phenoxy]hexanoate
SMILES: COC(=O)CCCCCOC1=CC=C(C=C1)NC(=O)OCCO

Molecular Processing

Molecular formula
C16H23NO6
Molecular weight
325.36
Exact mass
325.1525
XLogP
2.34
TPSA
94.09
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
84.48

Supplementary Information

InChIKey: BXHOKTLOWGVEPZ-UHFFFAOYSA-N
Synonyms
SCHEMBL830549BXHOKTLOWGVEPZ-UHFFFAOYSA-N6-[4-(2-Hydroxy-ethoxycarbonylamino)-phenoxy]-hexanoic acid methyl ester6-[4-(2-Hydroxyethoxycarbonylamino)-phenoxy]-hexanoic acid methyl ester
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Involved in 12 reactions→

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