4-[[2-(cyclohexylmethyl)phenyl]carbonylamino]-3-(phenylmethyl)benzoic acid

Systemtic Name: 4-[[2-(cyclohexylmethyl)phenyl]carbonylamino]-3-(phenylmethyl)benzoic acid Openeye Name: 3-benzyl-4-[[2-(cyclohexylmethyl)benzoyl]amino]benzoic acid CAS Name: 4-[[[2-(cyclohexylmethyl)phenyl]-oxomethyl]amino]-3-(phenylmethyl)benzoic acid IUPAC Name: 3-benzyl-4-[[2-(cyclohexylmethyl)benzoyl]amino]benzoic acid Traditional Name: 3-benzyl-4-[[2-(cyclohexylmethyl)benzoyl]amino]benzoic acid Formula: C28H29NO3 MolecularWeight: 427.53476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC2=CC=CC=C2C(=O)NC3=C(C=C(C=C3)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CC2=CC=CC=C2C(=O)NC3=C(C=C(C=C3)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C28H29NO3/c30-27(25-14-8-7-13-22(25)17-20-9-3-1-4-10-20)29-26-16-15-23(28(31)32)19-24(26)18-21-11-5-2-6-12-21/h2,5-8,11-16,19-20H,1,3-4,9-10,17-18H2,(H,29,30)(H,31,32)