2-[4-[(2-oxidanylidene-8-prop-2-enyl-chromen-3-yl)carbonylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(2-oxidanylidene-8-prop-2-enyl-chromen-3-yl)carbonylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[(8-allyl-2-oxo-chromene-3-carbonyl)amino]phenyl]acetic acid CAS Name: 2-[4-[[oxo-(2-oxo-8-prop-2-enyl-1-benzopyran-3-yl)methyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[(2-oxo-8-prop-2-enylchromene-3-carbonyl)amino]phenyl]acetic acid Traditional Name: 2-[4-[(8-allyl-2-keto-chromene-3-carbonyl)amino]phenyl]acetic acid Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C21H17NO5/c1-2-4-14-5-3-6-15-12-17(21(26)27-19(14)15)20(25)22-16-9-7-13(8-10-16)11-18(23)24/h2-3,5-10,12H,1,4,11H2,(H,22,25)(H,23,24)