2-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 2-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 2-[(E)-3-(4-bromophenyl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 2-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 2-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 2-[(E)-3-(4-bromophenyl)-3-keto-prop-1-enyl]benzoic acid Formula: C16H11BrO3 MolecularWeight: 331.16074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrO3/c17-13-8-5-12(6-9-13)15(18)10-7-11-3-1-2-4-14(11)16(19)20/h1-10H,(H,19,20)/b10-7+