methyl 3-azanyl-2-[[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 3-azanyl-2-[[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 3-amino-2-[[4-[(4-fluorophenyl)methyl]-1-piperidyl]methyl]benzoate CAS Name: 3-amino-2-[[4-[(4-fluorophenyl)methyl]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-amino-2-[[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methyl]benzoate Traditional Name: 3-amino-2-[[4-(4-fluorobenzyl)piperidino]methyl]benzoic acid methyl ester Formula: C21H25FN2O2 MolecularWeight: 356.433803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN2O2/c1-26-21(25)18-3-2-4-20(23)19(18)14-24-11-9-16(10-12-24)13-15-5-7-17(22)8-6-15/h2-8,16H,9-14,23H2,1H3