[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate

Systemtic Name: [2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate Openeye Name: [2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] 2-(benzylcarbamoylamino)acetate CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]amino]acetic acid [2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl] 2-(benzylcarbamoylamino)acetate Traditional Name: 2-(benzylcarbamoylamino)acetic acid [2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C21H25N3O4/c1-3-17-11-7-8-15(2)20(17)24-18(25)14-28-19(26)13-23-21(27)22-12-16-9-5-4-6-10-16/h4-11H,3,12-14H2,1-2H3,(H,24,25)(H2,22,23,27)