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

Systemtic Name: 2-[(E)-3-(4-carboxyphenyl)prop-2-enoyl]benzoic acid Openeye Name: 2-[(E)-3-(4-carboxyphenyl)prop-2-enoyl]benzoic acid CAS Name: 2-[(E)-3-(4-carboxyphenyl)-1-oxoprop-2-enyl]benzoic acid IUPAC Name: 2-[(E)-3-(4-carboxyphenyl)prop-2-enoyl]benzoic acid Traditional Name: 2-[(E)-3-(4-carboxyphenyl)acryloyl]benzoic acid Formula: C17H12O5 MolecularWeight: 296.27418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H12O5/c18-15(13-3-1-2-4-14(13)17(21)22)10-7-11-5-8-12(9-6-11)16(19)20/h1-10H,(H,19,20)(H,21,22)/b10-7+