methyl (E)-2-(cyanomethyl)-3-(5-nitro-2-phenylmethoxy-phenyl)prop-2-enoate

Systemtic Name: methyl (E)-2-(cyanomethyl)-3-(5-nitro-2-phenylmethoxy-phenyl)prop-2-enoate Openeye Name: methyl (E)-3-(2-benzyloxy-5-nitro-phenyl)-2-(cyanomethyl)prop-2-enoate CAS Name: (E)-2-(cyanomethyl)-3-(5-nitro-2-phenylmethoxyphenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-(cyanomethyl)-3-(5-nitro-2-phenylmethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2-benzoxy-5-nitro-phenyl)-2-(cyanomethyl)acrylic acid methyl ester Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(C=CC(=C1)[N+](=O)[O-])OCC2=CC=CC=C2)CC#N

Isomeric SMILES

COC(=O)/C(=C/C1=C(C=CC(=C1)[N+](=O)[O-])OCC2=CC=CC=C2)/CC#N

InChI

InChI=1S/C19H16N2O5/c1-25-19(22)15(9-10-20)11-16-12-17(21(23)24)7-8-18(16)26-13-14-5-3-2-4-6-14/h2-8,11-12H,9,13H2,1H3/b15-11+