methyl (E)-3-(2-ethanoyl-3-nitro-phenyl)prop-2-enoate

Systemtic Name: methyl (E)-3-(2-ethanoyl-3-nitro-phenyl)prop-2-enoate Openeye Name: methyl (E)-3-(2-acetyl-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-3-(2-acetyl-3-nitrophenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-acetyl-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(2-acetyl-3-nitro-phenyl)acrylic acid methyl ester Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC=C1[N+](=O)[O-])C=CC(=O)OC

Isomeric SMILES

CC(=O)C1=C(C=CC=C1[N+](=O)[O-])/C=C/C(=O)OC

InChI

InChI=1S/C12H11NO5/c1-8(14)12-9(6-7-11(15)18-2)4-3-5-10(12)13(16)17/h3-7H,1-2H3/b7-6+