1-[2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(3-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-[(3-chlorophenyl)methylamino]-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-[(3-chlorophenyl)methylamino]-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-[(3-chlorophenyl)methylamino]-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-[(3-chlorobenzyl)amino]-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C16H20ClNO3 MolecularWeight: 309.7879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NCC2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NCC2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C16H20ClNO3/c17-13-6-4-5-12(9-13)11-18-14(19)10-16(15(20)21)7-2-1-3-8-16/h4-6,9H,1-3,7-8,10-11H2,(H,18,19)(H,20,21)