[2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl] 2,3,6-tris(chloranyl)benzoate

Systemtic Name: [2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl] 2,3,6-tris(chloranyl)benzoate Openeye Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 2,3,6-trichlorobenzoate CAS Name: 2,3,6-trichlorobenzoic acid [2-oxo-3-[oxo-(phenethylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 2,3,6-trichlorobenzoate Traditional Name: 2,3,6-trichlorobenzoic acid [2-keto-3-(phenethylcarbamoyl)chromen-7-yl] ester Formula: C25H16Cl3NO5 MolecularWeight: 516.75724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC3=C(C=C(C=C3)OC(=O)C4=C(C=CC(=C4Cl)Cl)Cl)OC2=O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC3=C(C=C(C=C3)OC(=O)C4=C(C=CC(=C4Cl)Cl)Cl)OC2=O

InChI

InChI=1S/C25H16Cl3NO5/c26-18-8-9-19(27)22(28)21(18)25(32)33-16-7-6-15-12-17(24(31)34-20(15)13-16)23(30)29-11-10-14-4-2-1-3-5-14/h1-9,12-13H,10-11H2,(H,29,30)