(E)-N-(4-acetamidophenyl)-2-cyano-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(3-nitro-4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(3-nitro-4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)acrylamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4/c1-13(2)19-9-4-15(11-20(19)25(28)29)10-16(12-22)21(27)24-18-7-5-17(6-8-18)23-14(3)26/h4-11,13H,1-3H3,(H,23,26)(H,24,27)/b16-10+