4-[4-[4-[(3-tert-butylphenyl)carbamoyl]phenyl]piperidin-1-yl]benzoic acid

Systemtic Name: 4-[4-[4-[(3-tert-butylphenyl)carbamoyl]phenyl]piperidin-1-yl]benzoic acid Openeye Name: 4-[4-[4-[(3-tert-butylphenyl)carbamoyl]phenyl]-1-piperidyl]benzoic acid CAS Name: 4-[4-[4-[(3-tert-butylanilino)-oxomethyl]phenyl]-1-piperidinyl]benzoic acid IUPAC Name: 4-[4-[4-[(3-tert-butylphenyl)carbamoyl]phenyl]piperidin-1-yl]benzoic acid Traditional Name: 4-[4-[4-[(3-tert-butylphenyl)carbamoyl]phenyl]piperidino]benzoic acid Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C3CCN(CC3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C3CCN(CC3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C29H32N2O3/c1-29(2,3)24-5-4-6-25(19-24)30-27(32)22-9-7-20(8-10-22)21-15-17-31(18-16-21)26-13-11-23(12-14-26)28(33)34/h4-14,19,21H,15-18H2,1-3H3,(H,30,32)(H,33,34)