(E)-2-cyano-N-methyl-3-[4-(5-methyl-2-propan-2-yl-phenoxy)-3-nitro-phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-methyl-3-[4-(5-methyl-2-propan-2-yl-phenoxy)-3-nitro-phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(2-isopropyl-5-methyl-phenoxy)-3-nitro-phenyl]-N-methyl-prop-2-enamide CAS Name: (E)-2-cyano-N-methyl-3-[4-(5-methyl-2-propan-2-ylphenoxy)-3-nitrophenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-methyl-3-[4-(5-methyl-2-propan-2-ylphenoxy)-3-nitrophenyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(2-isopropyl-5-methyl-phenoxy)-3-nitro-phenyl]-N-methyl-acrylamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c1-13(2)17-7-5-14(3)9-20(17)28-19-8-6-15(11-18(19)24(26)27)10-16(12-22)21(25)23-4/h5-11,13H,1-4H3,(H,23,25)/b16-10+