1-[(4-chloranyl-3-nitro-phenyl)methyl]-3-(3-methoxyphenyl)piperidin-3-ol hydrochloride

Systemtic Name: 1-[(4-chloranyl-3-nitro-phenyl)methyl]-3-(3-methoxyphenyl)piperidin-3-ol hydrochloride Openeye Name: 1-[(4-chloro-3-nitro-phenyl)methyl]-3-(3-methoxyphenyl)piperidin-3-ol hydrochloride CAS Name: 1-[(4-chloro-3-nitrophenyl)methyl]-3-(3-methoxyphenyl)-3-piperidinol hydrochloride IUPAC Name: 1-[(4-chloro-3-nitrophenyl)methyl]-3-(3-methoxyphenyl)piperidin-3-ol hydrochloride Traditional Name: 1-(4-chloro-3-nitro-benzyl)-3-(3-methoxyphenyl)piperidin-3-ol hydrochloride Formula: C19H22Cl2N2O4 MolecularWeight: 413.29498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCCN(C2)CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])O.Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCCN(C2)CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C19H21ClN2O4.ClH/c1-26-16-5-2-4-15(11-16)19(23)8-3-9-21(13-19)12-14-6-7-17(20)18(10-14)22(24)25;/h2,4-7,10-11,23H,3,8-9,12-13H2,1H3;1H