6-(3-azanylpropyl)-9-methylsulfanyl-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione

Systemtic Name: 6-(3-azanylpropyl)-9-methylsulfanyl-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione Openeye Name: 6-(3-aminopropyl)-9-methylsulfanyl-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione CAS Name: 6-(3-aminopropyl)-9-(methylthio)-3-nitroindeno[1,2-c]isoquinoline-5,11-dione IUPAC Name: 6-(3-aminopropyl)-9-methylsulfanyl-3-nitroindeno[1,2-c]isoquinoline-5,11-dione Traditional Name: 6-(3-aminopropyl)-9-(methylthio)-3-nitro-inden[1,2-c]isoquinoline-5,11-quinone Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)C3=C(C2=O)C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CCCN

Isomeric SMILES

CSC1=CC2=C(C=C1)C3=C(C2=O)C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CCCN

InChI

InChI=1S/C20H17N3O4S/c1-28-12-4-6-14-15(10-12)19(24)17-13-5-3-11(23(26)27)9-16(13)20(25)22(18(14)17)8-2-7-21/h3-6,9-10H,2,7-8,21H2,1H3