4-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E)-3-(4-bromophenyl)acryloyl]amino]benzoic acid Formula: C16H12BrNO3 MolecularWeight: 346.17538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC2=CC=C(C=C2)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NC2=CC=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C16H12BrNO3/c17-13-6-1-11(2-7-13)3-10-15(19)18-14-8-4-12(5-9-14)16(20)21/h1-10H,(H,18,19)(H,20,21)/b10-3+