4-(4-nitrophenoxy)-1-phenethyl-3-phenyl-piperidine hydrochloride

Systemtic Name: 4-(4-nitrophenoxy)-1-phenethyl-3-phenyl-piperidine hydrochloride Openeye Name: 4-(4-nitrophenoxy)-1-phenethyl-3-phenyl-piperidine hydrochloride CAS Name: 4-(4-nitrophenoxy)-1-phenethyl-3-phenylpiperidine hydrochloride IUPAC Name: 4-(4-nitrophenoxy)-1-phenethyl-3-phenylpiperidine hydrochloride Traditional Name: 4-(4-nitrophenoxy)-1-phenethyl-3-phenyl-piperidine hydrochloride Formula: C25H27ClN2O3 MolecularWeight: 438.94648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)CCC4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CC(C1OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)CCC4=CC=CC=C4.Cl

InChI

InChI=1S/C25H26N2O3.ClH/c28-27(29)22-11-13-23(14-12-22)30-25-16-18-26(17-15-20-7-3-1-4-8-20)19-24(25)21-9-5-2-6-10-21;/h1-14,24-25H,15-19H2;1H