3-(5-bromanyl-2-hexoxy-phenyl)-2-cyano-N-(3-nitrophenyl)prop-2-enamide

Systemtic Name: 3-(5-bromanyl-2-hexoxy-phenyl)-2-cyano-N-(3-nitrophenyl)prop-2-enamide Openeye Name: 3-(5-bromo-2-hexoxy-phenyl)-2-cyano-N-(3-nitrophenyl)prop-2-enamide CAS Name: 3-(5-bromo-2-hexoxyphenyl)-2-cyano-N-(3-nitrophenyl)-2-propenamide IUPAC Name: 3-(5-bromo-2-hexoxyphenyl)-2-cyano-N-(3-nitrophenyl)prop-2-enamide Traditional Name: 3-(5-bromo-2-hexoxy-phenyl)-2-cyano-N-(3-nitrophenyl)acrylamide Formula: C22H22BrN3O4 MolecularWeight: 472.33178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H22BrN3O4/c1-2-3-4-5-11-30-21-10-9-18(23)13-16(21)12-17(15-24)22(27)25-19-7-6-8-20(14-19)26(28)29/h6-10,12-14H,2-5,11H2,1H3,(H,25,27)