[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 2-(2-benzamidoethanoylamino)ethanoate

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 2-(2-benzamidoethanoylamino)ethanoate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 2-[(2-benzamidoacetyl)amino]acetate CAS Name: 2-[(2-benzamido-1-oxoethyl)amino]acetic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 2-[(2-benzamidoacetyl)amino]acetate Traditional Name: 2-(hippuroylamino)acetic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)CNC(=O)CNC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)CNC(=O)CNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H22N2O5/c1-14-8-9-15(2)17(10-14)18(24)13-28-20(26)12-22-19(25)11-23-21(27)16-6-4-3-5-7-16/h3-10H,11-13H2,1-2H3,(H,22,25)(H,23,27)