2-[[(E)-3-(2-oxidanylidenechromen-3-yl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[(E)-3-(2-oxidanylidenechromen-3-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-(2-oxochromen-3-yl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-1-oxo-3-(2-oxo-1-benzopyran-3-yl)prop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-(2-oxochromen-3-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-(2-ketochromen-3-yl)acryloyl]amino]benzoic acid Formula: C19H13NO5 MolecularWeight: 335.31022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C=CC(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)/C=C/C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H13NO5/c21-17(20-15-7-3-2-6-14(15)18(22)23)10-9-13-11-12-5-1-4-8-16(12)25-19(13)24/h1-11H,(H,20,21)(H,22,23)/b10-9+