2-(3-methylsulfanylphenyl)-5-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(3-methylsulfanylphenyl)-5-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-methylsulfanylphenyl)-5-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[3-(methylthio)phenyl]-5-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-methylsulfanylphenyl)-5-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[3-(methylthio)phenyl]-5-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C19H12N2O4S MolecularWeight: 364.37458

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

InChI

InChI=1S/C19H12N2O4S/c1-26-14-6-3-5-12(9-14)20-18(22)15-7-2-4-11-8-13(21(24)25)10-16(17(11)15)19(20)23/h2-10H,1H3