2-[[(Z)-3-(2-oxidanylidenechromen-3-yl)but-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[(Z)-3-(2-oxidanylidenechromen-3-yl)but-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(Z)-3-(2-oxochromen-3-yl)but-2-enoyl]amino]benzoic acid CAS Name: 2-[[(Z)-1-oxo-3-(2-oxo-1-benzopyran-3-yl)but-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(Z)-3-(2-oxochromen-3-yl)but-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(Z)-3-(2-ketochromen-3-yl)but-2-enoyl]amino]benzoic acid Formula: C20H15NO5 MolecularWeight: 349.3368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=CC=CC=C3OC2=O

Isomeric SMILES

C/C(=C/C(=O)NC1=CC=CC=C1C(=O)O)/C2=CC3=CC=CC=C3OC2=O

InChI

InChI=1S/C20H15NO5/c1-12(15-11-13-6-2-5-9-17(13)26-20(15)25)10-18(22)21-16-8-4-3-7-14(16)19(23)24/h2-11H,1H3,(H,21,22)(H,23,24)/b12-10-