methyl 2-[(2-methoxy-2-oxidanylidene-ethyl)-(3-octadecoxyphenyl)carbonyl-amino]ethanoate

Systemtic Name: methyl 2-[(2-methoxy-2-oxidanylidene-ethyl)-(3-octadecoxyphenyl)carbonyl-amino]ethanoate Openeye Name: methyl 2-[(2-methoxy-2-oxo-ethyl)-(3-octadecoxybenzoyl)amino]acetate CAS Name: 2-[(2-methoxy-2-oxoethyl)-[(3-octadecoxyphenyl)-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-methoxy-2-oxoethyl)-(3-octadecoxybenzoyl)amino]acetate Traditional Name: 2-[(2-keto-2-methoxy-ethyl)-(3-stearyloxybenzoyl)amino]acetic acid methyl ester Formula: C31H51NO6 MolecularWeight: 533.73974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)C(=O)N(CC(=O)OC)CC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)C(=O)N(CC(=O)OC)CC(=O)OC

InChI

InChI=1S/C31H51NO6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-38-28-22-20-21-27(24-28)31(35)32(25-29(33)36-2)26-30(34)37-3/h20-22,24H,4-19,23,25-26H2,1-3H3