[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 2-methylbenzoate

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 2-methylbenzoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C22H21NO5 MolecularWeight: 379.40584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C

InChI

InChI=1S/C22H21NO5/c1-13(2)12-23-20(24)18-10-15-8-9-16(11-19(15)28-22(18)26)27-21(25)17-7-5-4-6-14(17)3/h4-11,13H,12H2,1-3H3,(H,23,24)