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

Systemtic Name: (E)-3-(4-butoxyphenyl)-N-(4-chloranyl-3-nitro-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(4-butoxyphenyl)-N-(4-chloro-3-nitro-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(4-butoxyphenyl)-N-(4-chloro-3-nitrophenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(4-butoxyphenyl)-N-(4-chloro-3-nitrophenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(4-butoxyphenyl)-N-(4-chloro-3-nitro-phenyl)-2-cyano-acrylamide Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN3O4/c1-2-3-10-28-17-7-4-14(5-8-17)11-15(13-22)20(25)23-16-6-9-18(21)19(12-16)24(26)27/h4-9,11-12H,2-3,10H2,1H3,(H,23,25)/b15-11+