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

Systemtic Name: methyl 2-[[4-(diphenylmethyl)piperidin-1-yl]methyl]-5-methoxy-benzoate Openeye Name: methyl 2-[(4-benzhydryl-1-piperidyl)methyl]-5-methoxy-benzoate CAS Name: 2-[[4-(diphenylmethyl)-1-piperidinyl]methyl]-5-methoxybenzoic acid methyl ester IUPAC Name: methyl 2-[(4-benzhydrylpiperidin-1-yl)methyl]-5-methoxybenzoate Traditional Name: 2-[(4-benzhydrylpiperidino)methyl]-5-methoxy-benzoic acid methyl ester Formula: C28H31NO3 MolecularWeight: 429.55064

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C28H31NO3/c1-31-25-14-13-24(26(19-25)28(30)32-2)20-29-17-15-23(16-18-29)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