6-chloranyl-2-[(2,2-dimethyl-1,3-dioxan-5-ylidene)methyl]-3-nitro-imidazo[1,2-b]pyridazine

Systemtic Name: 6-chloranyl-2-[(2,2-dimethyl-1,3-dioxan-5-ylidene)methyl]-3-nitro-imidazo[1,2-b]pyridazine Openeye Name: 6-chloro-2-[(2,2-dimethyl-1,3-dioxan-5-ylidene)methyl]-3-nitro-imidazo[1,2-b]pyridazine CAS Name: 6-chloro-2-[(2,2-dimethyl-1,3-dioxan-5-ylidene)methyl]-3-nitroimidazo[1,2-b]pyridazine IUPAC Name: 6-chloro-2-[(2,2-dimethyl-1,3-dioxan-5-ylidene)methyl]-3-nitroimidazo[1,2-b]pyridazine Traditional Name: 6-chloro-2-[(2,2-dimethyl-1,3-dioxan-5-ylidene)methyl]-3-nitro-imidazo[1,2-b]pyridazine Formula: C13H13ClN4O4 MolecularWeight: 324.71972

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(=CC2=C(N3C(=N2)C=CC(=N3)Cl)[N+](=O)[O-])CO1)C

Isomeric SMILES

CC1(OCC(=CC2=C(N3C(=N2)C=CC(=N3)Cl)[N+](=O)[O-])CO1)C

InChI

InChI=1S/C13H13ClN4O4/c1-13(2)21-6-8(7-22-13)5-9-12(18(19)20)17-11(15-9)4-3-10(14)16-17/h3-5H,6-7H2,1-2H3