4-[[(E)-3-(2-bromophenyl)-2-cyano-prop-2-enoyl]amino]benzoate

Systemtic Name: 4-[[(E)-3-(2-bromophenyl)-2-cyano-prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(E)-3-(2-bromophenyl)-2-cyano-prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(2-bromophenyl)-2-cyano-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-3-(2-bromophenyl)-2-cyanoprop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(2-bromophenyl)-2-cyano-acryloyl]amino]benzoate Formula: C17H10BrN2O3- MolecularWeight: 370.1769

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C(=O)[O-])Br

InChI

InChI=1S/C17H11BrN2O3/c18-15-4-2-1-3-12(15)9-13(10-19)16(21)20-14-7-5-11(6-8-14)17(22)23/h1-9H,(H,20,21)(H,22,23)/p-1/b13-9+