3-(4-phenylpiperidin-1-yl)propyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate hydrochloride

Systemtic Name: 3-(4-phenylpiperidin-1-yl)propyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate hydrochloride Openeye Name: 3-(4-phenyl-1-piperidyl)propyl 1-(4-nitrophenyl)cyclopentanecarboxylate hydrochloride CAS Name: 1-(4-nitrophenyl)-1-cyclopentanecarboxylic acid 3-(4-phenyl-1-piperidinyl)propyl ester hydrochloride IUPAC Name: 3-(4-phenylpiperidin-1-yl)propyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate hydrochloride Traditional Name: 1-(4-nitrophenyl)cyclopentanecarboxylic acid 3-(4-phenylpiperidino)propyl ester hydrochloride Formula: C26H33ClN2O4 MolecularWeight: 473.00422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCCN3CCC(CC3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCCN3CCC(CC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H32N2O4.ClH/c29-25(26(15-4-5-16-26)23-9-11-24(12-10-23)28(30)31)32-20-6-17-27-18-13-22(14-19-27)21-7-2-1-3-8-21;/h1-3,7-12,22H,4-6,13-20H2;1H