[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2,5-dimethylbenzoate

Systemtic Name: [2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2,5-dimethylbenzoate Openeye Name: [2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl] 2,5-dimethylbenzoate CAS Name: 2,5-dimethylbenzoic acid [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,5-dimethylbenzoate Traditional Name: 2,5-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=CC(=C(C=C1)C)C(=O)OCC(=O)NCC2=CC=CC=C2Cl

Isomeric SMILES

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

InChI

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