N-(1-butyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: N-(1-butyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: N-(1-butyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: N-(1-butyl-3-cyano-2-pyrrolo[3,2-b]quinoxalinyl)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: N-(1-butyl-3-cyanopyrrolo[3,2-b]quinoxalin-2-yl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: N-(1-butyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-3-(3-nitrophenyl)acrylamide Formula: C24H20N6O3 MolecularWeight: 440.454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N6O3/c1-2-3-13-29-23(28-21(31)12-11-16-7-6-8-17(14-16)30(32)33)18(15-25)22-24(29)27-20-10-5-4-9-19(20)26-22/h4-12,14H,2-3,13H2,1H3,(H,28,31)