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

Systemtic Name: 2-azanyl-6-(2,4-dichlorophenyl)-5-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(2,4-dichlorophenyl)-5-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(2,4-dichlorophenyl)-5-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(2,4-dichlorophenyl)-5-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(2,4-dichlorophenyl)-5-methyl-4-(6-nitro-1,3-benzodioxol-5-yl)nicotinonitrile Formula: C20H12Cl2N4O4 MolecularWeight: 443.23968

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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)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=C(N=C(C(=C1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C#N)N)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H12Cl2N4O4/c1-9-18(12-5-16-17(30-8-29-16)6-15(12)26(27)28)13(7-23)20(24)25-19(9)11-3-2-10(21)4-14(11)22/h2-6H,8H2,1H3,(H2,24,25)