3-azanyl-4-[(3-methyl-2-oxidanidyl-1,2-dihydrobenzo[f]quinazolin-2-ium-9-yl)methyl]-2,3-dihydroisoindol-1-one

Systemtic Name: 3-azanyl-4-[(3-methyl-2-oxidanidyl-1,2-dihydrobenzo[f]quinazolin-2-ium-9-yl)methyl]-2,3-dihydroisoindol-1-one Openeye Name: 3-amino-4-[(3-methyl-2-oxido-1,2-dihydrobenzo[f]quinazolin-2-ium-9-yl)methyl]isoindolin-1-one CAS Name: 3-amino-4-[(3-methyl-2-oxido-1,2-dihydrobenzo[f]quinazolin-2-ium-9-yl)methyl]-2,3-dihydroisoindol-1-one IUPAC Name: 3-amino-4-[(3-methyl-2-oxido-1,2-dihydrobenzo[f]quinazolin-2-ium-9-yl)methyl]-2,3-dihydroisoindol-1-one Traditional Name: 3-amino-4-[(3-methyl-2-oxido-1,2-dihydrobenzo[f]quinazolin-2-ium-9-yl)methyl]isoindolin-1-one Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C[NH+]1[O-])C3=C(C=CC(=C3)CC4=CC=CC5=C4C(NC5=O)N)C=C2

Isomeric SMILES

CC1=NC2=C(C[NH+]1[O-])C3=C(C=CC(=C3)CC4=CC=CC5=C4C(NC5=O)N)C=C2

InChI

InChI=1S/C22H20N4O2/c1-12-24-19-8-7-14-6-5-13(10-17(14)18(19)11-26(12)28)9-15-3-2-4-16-20(15)21(23)25-22(16)27/h2-8,10,21,26H,9,11,23H2,1H3,(H,25,27)