6-[bis(azanyl)methylidene]-3-nitro-2-(3-piperidin-1-ylpropoxy)cyclohexa-2,4-dien-1-one dihydrochloride

Systemtic Name: 6-[bis(azanyl)methylidene]-3-nitro-2-(3-piperidin-1-ylpropoxy)cyclohexa-2,4-dien-1-one dihydrochloride Openeye Name: 6-(diaminomethylene)-3-nitro-2-[3-(1-piperidyl)propoxy]cyclohexa-2,4-dien-1-one dihydrochloride CAS Name: 6-(diaminomethylidene)-3-nitro-2-[3-(1-piperidinyl)propoxy]-1-cyclohexa-2,4-dienone dihydrochloride IUPAC Name: 6-(diaminomethylidene)-3-nitro-2-(3-piperidin-1-ylpropoxy)cyclohexa-2,4-dien-1-one dihydrochloride Traditional Name: 6-(diaminomethylene)-3-nitro-2-(3-piperidinopropoxy)cyclohexa-2,4-dien-1-one dihydrochloride Formula: C15H24Cl2N4O4 MolecularWeight: 395.28146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=C(C=CC(=C(N)N)C2=O)[N+](=O)[O-].Cl.Cl

Isomeric SMILES

C1CCN(CC1)CCCOC2=C(C=CC(=C(N)N)C2=O)[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C15H22N4O4.2ClH/c16-15(17)11-5-6-12(19(21)22)14(13(11)20)23-10-4-9-18-7-2-1-3-8-18;;/h5-6H,1-4,7-10,16-17H2;2*1H