2-(chloranylcarbamoyl)-4-[[(4-cyclohexylphenyl)amino]methyl]benzoic acid

Systemtic Name: 2-(chloranylcarbamoyl)-4-[[(4-cyclohexylphenyl)amino]methyl]benzoic acid Openeye Name: 2-(chlorocarbamoyl)-4-[(4-cyclohexylanilino)methyl]benzoic acid CAS Name: 2-[(chloroamino)-oxomethyl]-4-[(4-cyclohexylanilino)methyl]benzoic acid IUPAC Name: 2-(chlorocarbamoyl)-4-[(4-cyclohexylanilino)methyl]benzoic acid Traditional Name: 2-(chlorocarbamoyl)-4-[(4-cyclohexylanilino)methyl]benzoic acid Formula: C21H23ClN2O3 MolecularWeight: 386.87192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)NCC3=CC(=C(C=C3)C(=O)O)C(=O)NCl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)NCC3=CC(=C(C=C3)C(=O)O)C(=O)NCl

InChI

InChI=1S/C21H23ClN2O3/c22-24-20(25)19-12-14(6-11-18(19)21(26)27)13-23-17-9-7-16(8-10-17)15-4-2-1-3-5-15/h6-12,15,23H,1-5,13H2,(H,24,25)(H,26,27)