2-[methyl-(2-oxidanylidene-8-prop-2-enyl-chromen-3-yl)carbonyl-amino]benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CC3=C(C(=CC=C3)CC=C)OC2=O

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CC3=C(C(=CC=C3)CC=C)OC2=O

InChI

InChI=1S/C21H17NO5/c1-3-7-13-8-6-9-14-12-16(21(26)27-18(13)14)19(23)22(2)17-11-5-4-10-15(17)20(24)25/h3-6,8-12H,1,7H2,2H3,(H,24,25)