1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol hydrochloride

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol hydrochloride Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol hydrochloride CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-3-(4-nitrophenoxy)-2-propanol hydrochloride IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol hydrochloride Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-3-(4-nitrophenoxy)propan-2-ol hydrochloride Formula: C19H23Cl2N3O4 MolecularWeight: 428.30962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC(=CC=C3)Cl.Cl

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC(=CC=C3)Cl.Cl

InChI

InChI=1S/C19H22ClN3O4.ClH/c20-15-2-1-3-17(12-15)22-10-8-21(9-11-22)13-18(24)14-27-19-6-4-16(5-7-19)23(25)26;/h1-7,12,18,24H,8-11,13-14H2;1H