6-azanyl-2-(4-methylphenyl)-5-(trioxidanylsulfanyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-azanyl-2-(4-methylphenyl)-5-(trioxidanylsulfanyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-amino-2-(p-tolyl)-5-(trioxidanylsulfanyl)benzo[de]isoquinoline-1,3-dione CAS Name: 6-amino-2-(4-methylphenyl)-1,3-dioxo-5-benzo[de]isoquinolinesulfenic acid hydroperoxy ester IUPAC Name: 6-amino-2-(4-methylphenyl)-5-(trioxidanylsulfanyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-amino-2-(p-tolyl)-5-(trioxidanylthio)benzo[de]isoquinoline-1,3-quinone Formula: C19H14N2O5S MolecularWeight: 382.38986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N)SOOO)C2=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N)SOOO)C2=O

InChI

InChI=1S/C19H14N2O5S/c1-10-5-7-11(8-6-10)21-18(22)13-4-2-3-12-16(13)14(19(21)23)9-15(17(12)20)27-26-25-24/h2-9,24H,20H2,1H3