N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(5-nitro-2-oxo-1-pyridyl)acetamide CAS Name: N-(3-cyano-4,5-dimethyl-1-phenyl-2-pyrrolyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide IUPAC Name: N-(3-cyano-4,5-dimethyl-1-phenylpyrrol-2-yl)-2-(5-nitro-2-oxopyridin-1-yl)acetamide Traditional Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(2-keto-5-nitro-1-pyridyl)acetamide Formula: C20H17N5O4 MolecularWeight: 391.38008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])C3=CC=CC=C3)C

InChI

InChI=1S/C20H17N5O4/c1-13-14(2)24(15-6-4-3-5-7-15)20(17(13)10-21)22-18(26)12-23-11-16(25(28)29)8-9-19(23)27/h3-9,11H,12H2,1-2H3,(H,22,26)