4-[[(Z)-3-(5-bromanylthiophen-3-yl)-2-cyano-prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[[(Z)-3-(5-bromanylthiophen-3-yl)-2-cyano-prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(Z)-3-(5-bromo-3-thienyl)-2-cyano-prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(Z)-3-(5-bromo-3-thiophenyl)-2-cyano-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(Z)-3-(5-bromothiophen-3-yl)-2-cyanoprop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(Z)-3-(5-bromo-3-thienyl)-2-cyano-acryloyl]amino]benzoic acid Formula: C15H9BrN2O3S MolecularWeight: 377.21256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)C(=CC2=CSC(=C2)Br)C#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)/C(=C\C2=CSC(=C2)Br)/C#N

InChI

InChI=1S/C15H9BrN2O3S/c16-13-6-9(8-22-13)5-11(7-17)14(19)18-12-3-1-10(2-4-12)15(20)21/h1-6,8H,(H,18,19)(H,20,21)/b11-5-