[2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl] 2-iodanylbenzoate

Systemtic Name: [2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl] 2-iodanylbenzoate Openeye Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [2-oxo-3-[oxo-(phenethylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [2-keto-3-(phenethylcarbamoyl)chromen-7-yl] ester Formula: C25H18INO5 MolecularWeight: 539.31859

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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=CC=CC=C4I)OC2=O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC3=C(C=C(C=C3)OC(=O)C4=CC=CC=C4I)OC2=O

InChI

InChI=1S/C25H18INO5/c26-21-9-5-4-8-19(21)24(29)31-18-11-10-17-14-20(25(30)32-22(17)15-18)23(28)27-13-12-16-6-2-1-3-7-16/h1-11,14-15H,12-13H2,(H,27,28)