2-[4-[cyclohexyl-(phenylmethyl)amino]-2-oxidanyl-phenyl]carbonylbenzoic acid

Systemtic Name: 2-[4-[cyclohexyl-(phenylmethyl)amino]-2-oxidanyl-phenyl]carbonylbenzoic acid Openeye Name: 2-[4-[benzyl(cyclohexyl)amino]-2-hydroxy-benzoyl]benzoic acid CAS Name: 2-[[4-[cyclohexyl-(phenylmethyl)amino]-2-hydroxyphenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[4-[benzyl(cyclohexyl)amino]-2-hydroxybenzoyl]benzoic acid Traditional Name: 2-[4-[benzyl(cyclohexyl)amino]-2-hydroxy-benzoyl]benzoic acid Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=CC=C2)C3=CC(=C(C=C3)C(=O)C4=CC=CC=C4C(=O)O)O

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=CC=C2)C3=CC(=C(C=C3)C(=O)C4=CC=CC=C4C(=O)O)O

InChI

InChI=1S/C27H27NO4/c29-25-17-21(15-16-24(25)26(30)22-13-7-8-14-23(22)27(31)32)28(20-11-5-2-6-12-20)18-19-9-3-1-4-10-19/h1,3-4,7-10,13-17,20,29H,2,5-6,11-12,18H2,(H,31,32)