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

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 2-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)propanoic 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)propanoate Traditional Name: 2-phthalimidopropionic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H16ClNO6 MolecularWeight: 425.81854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(C)N3C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(C)N3C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C22H16ClNO6/c1-11-7-18-16(9-17(11)23)13(8-19(25)30-18)10-29-22(28)12(2)24-20(26)14-5-3-4-6-15(14)21(24)27/h3-9,12H,10H2,1-2H3