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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OC3=CC4=C(C=C3)C(=O)C(=CO4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OC3=CC4=C(C=C3)C(=O)C(=CO4)Cl

InChI

InChI=1S/C21H14ClNO6/c22-16-11-28-17-10-12(7-8-15(17)19(16)25)29-18(24)6-3-9-23-20(26)13-4-1-2-5-14(13)21(23)27/h1-2,4-5,7-8,10-11H,3,6,9H2