3-(3-methoxyphenyl)-1-[2-(4-nitrophenyl)ethyl]-3-propyl-pyrrolidine hydrochloride

Systemtic Name: 3-(3-methoxyphenyl)-1-[2-(4-nitrophenyl)ethyl]-3-propyl-pyrrolidine hydrochloride Openeye Name: 3-(3-methoxyphenyl)-1-[2-(4-nitrophenyl)ethyl]-3-propyl-pyrrolidine hydrochloride CAS Name: 3-(3-methoxyphenyl)-1-[2-(4-nitrophenyl)ethyl]-3-propylpyrrolidine hydrochloride IUPAC Name: 3-(3-methoxyphenyl)-1-[2-(4-nitrophenyl)ethyl]-3-propylpyrrolidine hydrochloride Traditional Name: 3-(3-methoxyphenyl)-1-[2-(4-nitrophenyl)ethyl]-3-propyl-pyrrolidine hydrochloride Formula: C22H29ClN2O3 MolecularWeight: 404.93026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCN(C1)CCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=CC=C3)OC.Cl

Isomeric SMILES

CCCC1(CCN(C1)CCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=CC=C3)OC.Cl

InChI

InChI=1S/C22H28N2O3.ClH/c1-3-12-22(19-5-4-6-21(16-19)27-2)13-15-23(17-22)14-11-18-7-9-20(10-8-18)24(25)26;/h4-10,16H,3,11-15,17H2,1-2H3;1H