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

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 3-[(1,3-dioxoisoindolin-2-yl)methyl]benzoate CAS Name: 3-[(1,3-dioxo-2-isoindolyl)methyl]benzoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 3-[(1,3-dioxoisoindol-2-yl)methyl]benzoate Traditional Name: 3-(phthalimidomethyl)benzoic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C27H19NO6 MolecularWeight: 453.44286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H19NO6/c1-16-9-10-20-19(13-24(29)34-23(20)11-16)15-33-27(32)18-6-4-5-17(12-18)14-28-25(30)21-7-2-3-8-22(21)26(28)31/h2-13H,14-15H2,1H3