(E)-2-cyano-N-(3-nitrophenyl)-3-(3-pentoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-nitrophenyl)-3-(3-pentoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-nitrophenyl)-3-(3-pentoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-nitrophenyl)-3-(3-pentoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-nitrophenyl)-3-(3-pentoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(3-amoxyphenyl)-2-cyano-N-(3-nitrophenyl)acrylamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c1-2-3-4-11-28-20-10-5-7-16(13-20)12-17(15-22)21(25)23-18-8-6-9-19(14-18)24(26)27/h5-10,12-14H,2-4,11H2,1H3,(H,23,25)/b17-12+