methyl 4-[[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]methyl]benzoate Openeye Name: methyl 4-[[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]methyl]benzoate CAS Name: 4-[[[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]methyl]benzoate Traditional Name: 4-[[[(E)-3-(2-nitrophenyl)acryloyl]amino]methyl]benzoic acid methyl ester Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O5/c1-25-18(22)15-8-6-13(7-9-15)12-19-17(21)11-10-14-4-2-3-5-16(14)20(23)24/h2-11H,12H2,1H3,(H,19,21)/b11-10+