2-(4-phenylpiperidin-1-yl)ethyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate hydrochloride

Systemtic Name: 2-(4-phenylpiperidin-1-yl)ethyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate hydrochloride Openeye Name: 2-(4-phenyl-1-piperidyl)ethyl 1-(4-nitrophenyl)cyclopentanecarboxylate hydrochloride CAS Name: 1-(4-nitrophenyl)-1-cyclopentanecarboxylic acid 2-(4-phenyl-1-piperidinyl)ethyl ester hydrochloride IUPAC Name: 2-(4-phenylpiperidin-1-yl)ethyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate hydrochloride Traditional Name: 1-(4-nitrophenyl)cyclopentanecarboxylic acid 2-(4-phenylpiperidino)ethyl ester hydrochloride Formula: C25H31ClN2O4 MolecularWeight: 458.97764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCN3CCC(CC3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCN3CCC(CC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H30N2O4.ClH/c28-24(25(14-4-5-15-25)22-8-10-23(11-9-22)27(29)30)31-19-18-26-16-12-21(13-17-26)20-6-2-1-3-7-20;/h1-3,6-11,21H,4-5,12-19H2;1H