2-cyano-3-[(2-methyl-5-nitro-phenyl)amino]-N-(2-phenylethanoyl)prop-2-enamide

Systemtic Name: 2-cyano-3-[(2-methyl-5-nitro-phenyl)amino]-N-(2-phenylethanoyl)prop-2-enamide Openeye Name: 2-cyano-3-(2-methyl-5-nitro-anilino)-N-(2-phenylacetyl)prop-2-enamide CAS Name: 2-cyano-3-(2-methyl-5-nitroanilino)-N-(1-oxo-2-phenylethyl)-2-propenamide IUPAC Name: 2-cyano-3-(2-methyl-5-nitroanilino)-N-(2-phenylacetyl)prop-2-enamide Traditional Name: 2-cyano-3-(2-methyl-5-nitro-anilino)-N-(2-phenylacetyl)acrylamide Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC=C(C#N)C(=O)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC=C(C#N)C(=O)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H16N4O4/c1-13-7-8-16(23(26)27)10-17(13)21-12-15(11-20)19(25)22-18(24)9-14-5-3-2-4-6-14/h2-8,10,12,21H,9H2,1H3,(H,22,24,25)