[3-(butan-2-ylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-methoxybenzoate

Systemtic Name: [3-(butan-2-ylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 4-methoxybenzoate Openeye Name: [2-oxo-3-(sec-butylcarbamoyl)chromen-7-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [3-[(butan-2-ylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(butan-2-ylcarbamoyl)-2-oxochromen-7-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [2-keto-3-(sec-butylcarbamoyl)chromen-7-yl] ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21NO6/c1-4-13(2)23-20(24)18-11-15-7-10-17(12-19(15)29-22(18)26)28-21(25)14-5-8-16(27-3)9-6-14/h5-13H,4H2,1-3H3,(H,23,24)