[3-(3-methoxypropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3-chloranylbenzoate

Systemtic Name: [3-(3-methoxypropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3-chloranylbenzoate Openeye Name: [3-(3-methoxypropylcarbamoyl)-2-oxo-chromen-7-yl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [3-[(3-methoxypropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methoxypropylcarbamoyl)-2-oxochromen-7-yl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-keto-3-(3-methoxypropylcarbamoyl)chromen-7-yl] ester Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClNO6/c1-27-9-3-8-23-19(24)17-11-13-6-7-16(12-18(13)29-21(17)26)28-20(25)14-4-2-5-15(22)10-14/h2,4-7,10-12H,3,8-9H2,1H3,(H,23,24)