(E)-2-cyano-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-N-(2-methylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-N-(2-methylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)-N-(o-tolyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-N-(2-methylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-N-(2-methylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)-N-(o-tolyl)acrylamide Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CC2=CC(=C(C(=C2)OC)O)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C/C2=CC(=C(C(=C2)OC)O)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H15N3O5/c1-11-5-3-4-6-14(11)20-18(23)13(10-19)7-12-8-15(21(24)25)17(22)16(9-12)26-2/h3-9,22H,1-2H3,(H,20,23)/b13-7+