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

Systemtic Name: (E)-N-(4-acetamidophenyl)-3-(4-chloranyl-3-nitro-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-3-(4-chloro-3-nitro-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-3-(4-chloro-3-nitrophenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-3-(4-chloro-3-nitrophenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-3-(4-chloro-3-nitro-phenyl)-2-cyano-acrylamide Formula: C18H13ClN4O4 MolecularWeight: 384.77322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H13ClN4O4/c1-11(24)21-14-3-5-15(6-4-14)22-18(25)13(10-20)8-12-2-7-16(19)17(9-12)23(26)27/h2-9H,1H3,(H,21,24)(H,22,25)/b13-8+