[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3,4,5-triethoxybenzoate

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3,4,5-triethoxybenzoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C27H31NO8 MolecularWeight: 497.53694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C

InChI

InChI=1S/C27H31NO8/c1-6-32-22-12-18(13-23(33-7-2)24(22)34-8-3)26(30)35-19-10-9-17-11-20(25(29)28-15-16(4)5)27(31)36-21(17)14-19/h9-14,16H,6-8,15H2,1-5H3,(H,28,29)