N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-6-nitro-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-6-nitro-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-nitro-1,3-benzodioxole-5-carboxamide CAS Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-nitro-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-nitro-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]-6-nitro-piperonylamide Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C

InChI

InChI=1S/C16H15N3O6/c1-8-3-9(2)18-16(21)11(8)6-17-15(20)10-4-13-14(25-7-24-13)5-12(10)19(22)23/h3-5H,6-7H2,1-2H3,(H,17,20)(H,18,21)