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

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 2-(1,3-dioxoisoindolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-2-isoindolyl)acetic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 2-(1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-phthalimidoacetic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H14ClNO6 MolecularWeight: 411.79196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CN3C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CN3C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C21H14ClNO6/c1-11-6-17-15(8-16(11)22)12(7-18(24)29-17)10-28-19(25)9-23-20(26)13-4-2-3-5-14(13)21(23)27/h2-8H,9-10H2,1H3