[3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] benzoate

Systemtic Name: [3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] benzoate Openeye Name: [3-(butylcarbamoyl)-2-oxo-chromen-7-yl] benzoate CAS Name: benzoic acid [3-[butylamino(oxo)methyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(butylcarbamoyl)-2-oxochromen-7-yl] benzoate Traditional Name: benzoic acid [3-(butylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19NO5/c1-2-3-11-22-19(23)17-12-15-9-10-16(13-18(15)27-21(17)25)26-20(24)14-7-5-4-6-8-14/h4-10,12-13H,2-3,11H2,1H3,(H,22,23)