[1-ethyl-4-(4-nitrophenyl)-4-oxidanyl-piperidin-3-yl]-(4-nitrophenyl)methanone hydrochloride

Systemtic Name: [1-ethyl-4-(4-nitrophenyl)-4-oxidanyl-piperidin-3-yl]-(4-nitrophenyl)methanone hydrochloride Openeye Name: [1-ethyl-4-hydroxy-4-(4-nitrophenyl)-3-piperidyl]-(4-nitrophenyl)methanone hydrochloride CAS Name: [1-ethyl-4-hydroxy-4-(4-nitrophenyl)-3-piperidinyl]-(4-nitrophenyl)methanone hydrochloride IUPAC Name: [1-ethyl-4-hydroxy-4-(4-nitrophenyl)piperidin-3-yl]-(4-nitrophenyl)methanone hydrochloride Traditional Name: [1-ethyl-4-hydroxy-4-(4-nitrophenyl)-3-piperidyl]-(4-nitrophenyl)methanone hydrochloride Formula: C20H22ClN3O6 MolecularWeight: 435.85818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(C(C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=C(C=C3)[N+](=O)[O-])O.Cl

Isomeric SMILES

CCN1CCC(C(C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=C(C=C3)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C20H21N3O6.ClH/c1-2-21-12-11-20(25,15-5-9-17(10-6-15)23(28)29)18(13-21)19(24)14-3-7-16(8-4-14)22(26)27;/h3-10,18,25H,2,11-13H2,1H3;1H