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

Systemtic Name: [2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3,4-dimethylbenzoate Openeye Name: [2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-[(2-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C18H18ClNO3 MolecularWeight: 331.79342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC2=CC=CC=C2Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC2=CC=CC=C2Cl)C

InChI

InChI=1S/C18H18ClNO3/c1-12-7-8-14(9-13(12)2)18(22)23-11-17(21)20-10-15-5-3-4-6-16(15)19/h3-9H,10-11H2,1-2H3,(H,20,21)