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

Systemtic Name: (2-oxidanylidenechromen-7-yl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (2-oxochromen-7-yl) 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (2-ketochromen-7-yl) ester Formula: C21H15NO6 MolecularWeight: 377.3469

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C21H15NO6/c23-18(27-14-9-7-13-8-10-19(24)28-17(13)12-14)6-3-11-22-20(25)15-4-1-2-5-16(15)21(22)26/h1-2,4-5,7-10,12H,3,6,11H2