[1-[(4-nitrophenyl)methyl]piperidin-4-yl] benzoate

Systemtic Name: [1-[(4-nitrophenyl)methyl]piperidin-4-yl] benzoate Openeye Name: [1-[(4-nitrophenyl)methyl]-4-piperidyl] benzoate CAS Name: benzoic acid [1-[(4-nitrophenyl)methyl]-4-piperidinyl] ester IUPAC Name: [1-[(4-nitrophenyl)methyl]piperidin-4-yl] benzoate Traditional Name: benzoic acid [1-(4-nitrobenzyl)-4-piperidyl] ester Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1OC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O4/c22-19(16-4-2-1-3-5-16)25-18-10-12-20(13-11-18)14-15-6-8-17(9-7-15)21(23)24/h1-9,18H,10-14H2