ethyl 4-[[(E)-3-(5-nitro-2-oxidanyl-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-3-(5-nitro-2-oxidanyl-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-3-(2-hydroxy-5-nitro-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(2-hydroxy-5-nitrophenyl)-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(2-hydroxy-5-nitrophenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(2-hydroxy-5-nitro-phenyl)acryloyl]amino]benzoic acid ethyl ester Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H16N2O6/c1-2-26-18(23)12-3-6-14(7-4-12)19-17(22)10-5-13-11-15(20(24)25)8-9-16(13)21/h3-11,21H,2H2,1H3,(H,19,22)/b10-5+