3-[[9-[3-[dimethyl(oxidanidyl)azaniumyl]propylamino]-5,10-bis(oxidanylidene)benzo[g]isoquinolin-6-yl]amino]-N,N-dimethyl-propan-1-amine oxide

Systemtic Name: 3-[[9-[3-[dimethyl(oxidanidyl)azaniumyl]propylamino]-5,10-bis(oxidanylidene)benzo[g]isoquinolin-6-yl]amino]-N,N-dimethyl-propan-1-amine oxide Openeye Name: 3-[[9-[3-[dimethyl(oxido)ammonio]propylamino]-5,10-dioxo-benzo[g]isoquinolin-6-yl]amino]-N,N-dimethyl-propan-1-amine oxide CAS Name: 3-[[9-[3-[dimethyl(oxido)ammonio]propylamino]-5,10-dioxo-6-benzo[g]isoquinolinyl]amino]-N,N-dimethyl-1-propanamine oxide IUPAC Name: 3-[[9-[3-[dimethyl(oxido)azaniumyl]propylamino]-5,10-dioxobenzo[g]isoquinolin-6-yl]amino]-N,N-dimethylpropan-1-amine oxide Traditional Name: 3-[[9-[3-[dimethyl(oxido)ammonio]propylamino]-5,10-diketo-benz[g]isoquinolin-6-yl]amino]-N,N-dimethyl-propan-1-amine oxide Formula: C23H31N5O4 MolecularWeight: 441.52334

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCNC1=C2C(=C(C=C1)NCCC[N+](C)(C)[O-])C(=O)C3=C(C2=O)C=CN=C3)[O-]

Isomeric SMILES

C[N+](C)(CCCNC1=C2C(=C(C=C1)NCCC[N+](C)(C)[O-])C(=O)C3=C(C2=O)C=CN=C3)[O-]

InChI

InChI=1S/C23H31N5O4/c1-27(2,31)13-5-10-25-18-7-8-19(26-11-6-14-28(3,4)32)21-20(18)22(29)16-9-12-24-15-17(16)23(21)30/h7-9,12,15,25-26H,5-6,10-11,13-14H2,1-4H3