3-nitro-6-[(5-oxidanylidene-5-phenyl-pentyl)amino]pyridine-2-carbonitrile

Systemtic Name: 3-nitro-6-[(5-oxidanylidene-5-phenyl-pentyl)amino]pyridine-2-carbonitrile Openeye Name: 3-nitro-6-[(5-oxo-5-phenyl-pentyl)amino]pyridine-2-carbonitrile CAS Name: 3-nitro-6-[(5-oxo-5-phenylpentyl)amino]-2-pyridinecarbonitrile IUPAC Name: 3-nitro-6-[(5-oxo-5-phenylpentyl)amino]pyridine-2-carbonitrile Traditional Name: 6-[(5-keto-5-phenyl-pentyl)amino]-3-nitro-picolinonitrile Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCCCNC2=NC(=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCCCNC2=NC(=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H16N4O3/c18-12-14-15(21(23)24)9-10-17(20-14)19-11-5-4-8-16(22)13-6-2-1-3-7-13/h1-3,6-7,9-10H,4-5,8,11H2,(H,19,20)