[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3,5-diacetamidobenzoate

Systemtic Name: [2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3,5-diacetamidobenzoate Openeye Name: [2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl] 3,5-diacetamidobenzoate CAS Name: 3,5-diacetamidobenzoic acid [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] 3,5-diacetamidobenzoate Traditional Name: 3,5-diacetamidobenzoic acid [2-[(4-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C20H20ClN3O5 MolecularWeight: 417.8429

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)OCC(=O)NCC2=CC=C(C=C2)Cl)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)OCC(=O)NCC2=CC=C(C=C2)Cl)NC(=O)C

InChI

InChI=1S/C20H20ClN3O5/c1-12(25)23-17-7-15(8-18(9-17)24-13(2)26)20(28)29-11-19(27)22-10-14-3-5-16(21)6-4-14/h3-9H,10-11H2,1-2H3,(H,22,27)(H,23,25)(H,24,26)