2-[4-[[2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl]oxymethyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl]oxymethyl]phenyl]ethanoic acid Openeye Name: 2-[4-[[3-(isopropylcarbamoyl)-2-oxo-chromen-7-yl]oxymethyl]phenyl]acetic acid CAS Name: 2-[4-[[2-oxo-3-[oxo-(propan-2-ylamino)methyl]-1-benzopyran-7-yl]oxymethyl]phenyl]acetic acid IUPAC Name: 2-[4-[[2-oxo-3-(propan-2-ylcarbamoyl)chromen-7-yl]oxymethyl]phenyl]acetic acid Traditional Name: 2-[4-[[3-(isopropylcarbamoyl)-2-keto-chromen-7-yl]oxymethyl]phenyl]acetic acid Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(C=C(C=C2)OCC3=CC=C(C=C3)CC(=O)O)OC1=O

Isomeric SMILES

CC(C)NC(=O)C1=CC2=C(C=C(C=C2)OCC3=CC=C(C=C3)CC(=O)O)OC1=O

InChI

InChI=1S/C22H21NO6/c1-13(2)23-21(26)18-10-16-7-8-17(11-19(16)29-22(18)27)28-12-15-5-3-14(4-6-15)9-20(24)25/h3-8,10-11,13H,9,12H2,1-2H3,(H,23,26)(H,24,25)