5-[[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[3-(isobutylcarbamoyl)-2-keto-chromen-7-yl]oxymethyl]-2-furoic acid Formula: C20H19NO7 MolecularWeight: 385.36736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OCC3=CC=C(O3)C(=O)O)OC1=O

Isomeric SMILES

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OCC3=CC=C(O3)C(=O)O)OC1=O

InChI

InChI=1S/C20H19NO7/c1-11(2)9-21-18(22)15-7-12-3-4-13(8-17(12)28-20(15)25)26-10-14-5-6-16(27-14)19(23)24/h3-8,11H,9-10H2,1-2H3,(H,21,22)(H,23,24)