dimethyl 5-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H15ClN2O7 MolecularWeight: 418.7846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H15ClN2O7/c1-28-18(24)12-8-13(19(25)29-2)10-14(9-12)21-17(23)6-4-11-3-5-15(20)16(7-11)22(26)27/h3-10H,1-2H3,(H,21,23)/b6-4+