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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)C(=O)O)CC4=CC=CC=C4

InChI

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