[2-[4-(3-acetamidopropyl)phenyl]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate

Systemtic Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate Openeye Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxo-ethyl] 2-(benzylcarbamoylamino)acetate CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]amino]acetic acid [2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] 2-(benzylcarbamoylamino)acetate Traditional Name: 2-(benzylcarbamoylamino)acetic acid [2-[4-(3-acetamidopropyl)phenyl]-2-keto-ethyl] ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=CC=C(C=C1)C(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(=O)NCCCC1=CC=C(C=C1)C(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C23H27N3O5/c1-17(27)24-13-5-8-18-9-11-20(12-10-18)21(28)16-31-22(29)15-26-23(30)25-14-19-6-3-2-4-7-19/h2-4,6-7,9-12H,5,8,13-16H2,1H3,(H,24,27)(H2,25,26,30)