1-[(3,5-dimethylphenyl)methyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[(3,5-dimethylphenyl)methyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[(3,5-dimethylphenyl)methyl]-5-nitro-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[(3,5-dimethylphenyl)methyl]-5-nitro-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[(3,5-dimethylphenyl)methyl]-5-nitro-2-oxopyridine-3-carbonitrile Traditional Name: 1-(3,5-dimethylbenzyl)-2-keto-5-nitro-nicotinonitrile Formula: C15H13N3O3 MolecularWeight: 283.28202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C15H13N3O3/c1-10-3-11(2)5-12(4-10)8-17-9-14(18(20)21)6-13(7-16)15(17)19/h3-6,9H,8H2,1-2H3