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

Systemtic Name: 2-azanyl-5-ethyl-6-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile Openeye Name: 2-amino-5-ethyl-6-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile CAS Name: 2-amino-5-ethyl-6-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-5-ethyl-6-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile Traditional Name: 2-amino-5-ethyl-6-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)nicotinonitrile Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(C(=C1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C#N)N)C

Isomeric SMILES

CCC1=C(N=C(C(=C1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C#N)N)C

InChI

InChI=1S/C16H14N4O4/c1-3-9-8(2)19-16(18)11(6-17)15(9)10-4-13-14(24-7-23-13)5-12(10)20(21)22/h4-5H,3,7H2,1-2H3,(H2,18,19)