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

Systemtic Name: 3-(3-methoxyphenyl)-1-[(4-methyl-3-nitro-phenyl)methyl]piperidin-3-ol hydrochloride Openeye Name: 3-(3-methoxyphenyl)-1-[(4-methyl-3-nitro-phenyl)methyl]piperidin-3-ol hydrochloride CAS Name: 3-(3-methoxyphenyl)-1-[(4-methyl-3-nitrophenyl)methyl]-3-piperidinol hydrochloride IUPAC Name: 3-(3-methoxyphenyl)-1-[(4-methyl-3-nitrophenyl)methyl]piperidin-3-ol hydrochloride Traditional Name: 3-(3-methoxyphenyl)-1-(4-methyl-3-nitro-benzyl)piperidin-3-ol hydrochloride Formula: C20H25ClN2O4 MolecularWeight: 392.8765

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2CCCC(C2)(C3=CC(=CC=C3)OC)O)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCCC(C2)(C3=CC(=CC=C3)OC)O)[N+](=O)[O-].Cl

InChI

InChI=1S/C20H24N2O4.ClH/c1-15-7-8-16(11-19(15)22(24)25)13-21-10-4-9-20(23,14-21)17-5-3-6-18(12-17)26-2;/h3,5-8,11-12,23H,4,9-10,13-14H2,1-2H3;1H