[1-[(2-nitrophenyl)methyl]piperidin-4-yl] benzoate hydrochloride

Systemtic Name: [1-[(2-nitrophenyl)methyl]piperidin-4-yl] benzoate hydrochloride Openeye Name: [1-[(2-nitrophenyl)methyl]-4-piperidyl] benzoate hydrochloride CAS Name: benzoic acid [1-[(2-nitrophenyl)methyl]-4-piperidinyl] ester hydrochloride IUPAC Name: [1-[(2-nitrophenyl)methyl]piperidin-4-yl] benzoate hydrochloride Traditional Name: benzoic acid [1-(2-nitrobenzyl)-4-piperidyl] ester hydrochloride Formula: C19H21ClN2O4 MolecularWeight: 376.83404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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