(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl 3-(1,3-dioxoisoindolin-2-yl)benzoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)benzoic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl 3-(1,3-dioxoisoindol-2-yl)benzoate Traditional Name: 3-phthalimidobenzoic acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C27H19NO7 MolecularWeight: 469.44226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O)O

InChI

InChI=1S/C27H19NO7/c1-2-15-11-21-17(12-24(30)35-23(21)13-22(15)29)14-34-27(33)16-6-5-7-18(10-16)28-25(31)19-8-3-4-9-20(19)26(28)32/h3-13,29H,2,14H2,1H3