2-azanyl-5,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-5,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile Openeye Name: 2-amino-5,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile CAS Name: 2-amino-5,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-5,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile Traditional Name: 2-amino-5,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)nicotinonitrile Formula: C15H12N4O4 MolecularWeight: 312.28018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C#N)N)C

Isomeric SMILES

CC1=C(N=C(C(=C1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C#N)N)C

InChI

InChI=1S/C15H12N4O4/c1-7-8(2)18-15(17)10(5-16)14(7)9-3-12-13(23-6-22-12)4-11(9)19(20)21/h3-4H,6H2,1-2H3,(H2,17,18)