5-(dimethylamino)-2-[[4-(diphenylmethyl)piperidin-1-yl]methyl]benzoic acid

Systemtic Name: 5-(dimethylamino)-2-[[4-(diphenylmethyl)piperidin-1-yl]methyl]benzoic acid Openeye Name: 2-[(4-benzhydryl-1-piperidyl)methyl]-5-(dimethylamino)benzoic acid CAS Name: 5-(dimethylamino)-2-[[4-(diphenylmethyl)-1-piperidinyl]methyl]benzoic acid IUPAC Name: 2-[(4-benzhydrylpiperidin-1-yl)methyl]-5-(dimethylamino)benzoic acid Traditional Name: 2-[(4-benzhydrylpiperidino)methyl]-5-(dimethylamino)benzoic acid Formula: C28H32N2O2 MolecularWeight: 428.56588

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1)CN2CCC(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)CN2CCC(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H32N2O2/c1-29(2)25-14-13-24(26(19-25)28(31)32)20-30-17-15-23(16-18-30)27(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,19,23,27H,15-18,20H2,1-2H3,(H,31,32)