3-[(6aS)-5,11-bis(oxidanylidene)-6aH-isoindolo[2,1-a]quinazolin-6-yl]propanoate

Systemtic Name: 3-[(6aS)-5,11-bis(oxidanylidene)-6aH-isoindolo[2,1-a]quinazolin-6-yl]propanoate Openeye Name: 3-[(6aS)-5,11-dioxo-6aH-isoindolo[2,1-a]quinazolin-6-yl]propanoate CAS Name: 3-[(6aS)-5,11-dioxo-6aH-isoindolo[2,1-a]quinazolin-6-yl]propanoate IUPAC Name: 3-[(6aS)-5,11-dioxo-6aH-isoindolo[2,1-a]quinazolin-6-yl]propanoate Traditional Name: 3-[(6aS)-5,11-diketo-6aH-isoindolo[2,1-a]quinazolin-6-yl]propionate Formula: C18H13N2O4- MolecularWeight: 321.30682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3N(C(=O)C4=CC=CC=C4N3C2=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)[C@H]3N(C(=O)C4=CC=CC=C4N3C2=O)CCC(=O)[O-]

InChI

InChI=1S/C18H14N2O4/c21-15(22)9-10-19-16-11-5-1-2-6-12(11)18(24)20(16)14-8-4-3-7-13(14)17(19)23/h1-8,16H,9-10H2,(H,21,22)/p-1/t16-/m0/s1