(E)-2-cyano-3-(4-nitro-3-oxidanyl-phenyl)-N-(3-phenylpropyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-nitro-3-oxidanyl-phenyl)-N-(3-phenylpropyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(3-hydroxy-4-nitro-phenyl)-N-(3-phenylpropyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(3-hydroxy-4-nitrophenyl)-N-(3-phenylpropyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-hydroxy-4-nitrophenyl)-N-(3-phenylpropyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3-hydroxy-4-nitro-phenyl)-N-(3-phenylpropyl)acrylamide Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)/C(=C/C2=CC(=C(C=C2)[N+](=O)[O-])O)/C#N

InChI

InChI=1S/C19H17N3O4/c20-13-16(11-15-8-9-17(22(25)26)18(23)12-15)19(24)21-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,23H,4,7,10H2,(H,21,24)/b16-11+