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

Systemtic Name: 2-[[4-(diphenylmethyl)piperidin-1-yl]methyl]-5-methoxy-benzoic acid Openeye Name: 2-[(4-benzhydryl-1-piperidyl)methyl]-5-methoxy-benzoic acid CAS Name: 2-[[4-(diphenylmethyl)-1-piperidinyl]methyl]-5-methoxybenzoic acid IUPAC Name: 2-[(4-benzhydrylpiperidin-1-yl)methyl]-5-methoxybenzoic acid Traditional Name: 2-[(4-benzhydrylpiperidino)methyl]-5-methoxy-benzoic acid Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCC(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCC(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H29NO3/c1-31-24-13-12-23(25(18-24)27(29)30)19-28-16-14-22(15-17-28)26(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-13,18,22,26H,14-17,19H2,1H3,(H,29,30)