methyl 3-azanyl-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 3-azanyl-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]benzoate Openeye Name: methyl 3-amino-4-[(4-benzyl-1-piperidyl)methyl]benzoate CAS Name: 3-amino-4-[[4-(phenylmethyl)-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-amino-4-[(4-benzylpiperidin-1-yl)methyl]benzoate Traditional Name: 3-amino-4-[(4-benzylpiperidino)methyl]benzoic acid methyl ester Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)CN2CCC(CC2)CC3=CC=CC=C3)N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)CN2CCC(CC2)CC3=CC=CC=C3)N

InChI

InChI=1S/C21H26N2O2/c1-25-21(24)18-7-8-19(20(22)14-18)15-23-11-9-17(10-12-23)13-16-5-3-2-4-6-16/h2-8,14,17H,9-13,15,22H2,1H3