6,9-bis[2-(4-oxidanidylmorpholin-4-ium-4-yl)ethylamino]benzo[g]isoquinoline-5,10-dione

Systemtic Name: 6,9-bis[2-(4-oxidanidylmorpholin-4-ium-4-yl)ethylamino]benzo[g]isoquinoline-5,10-dione Openeye Name: 6,9-bis[2-(4-oxidomorpholin-4-ium-4-yl)ethylamino]benzo[g]isoquinoline-5,10-dione CAS Name: 6,9-bis[2-(4-oxido-4-morpholin-4-iumyl)ethylamino]benzo[g]isoquinoline-5,10-dione IUPAC Name: 6,9-bis[2-(4-oxidomorpholin-4-ium-4-yl)ethylamino]benzo[g]isoquinoline-5,10-dione Traditional Name: 6,9-bis[2-(4-oxidomorpholin-4-ium-4-yl)ethylamino]benz[g]isoquinoline-5,10-quinone Formula: C25H31N5O6 MolecularWeight: 497.54354

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1(CCNC2=C3C(=C(C=C2)NCC[N+]4(CCOCC4)[O-])C(=O)C5=C(C3=O)C=CN=C5)[O-]

Isomeric SMILES

C1COCC[N+]1(CCNC2=C3C(=C(C=C2)NCC[N+]4(CCOCC4)[O-])C(=O)C5=C(C3=O)C=CN=C5)[O-]

InChI

InChI=1S/C25H31N5O6/c31-24-18-3-4-26-17-19(18)25(32)23-21(28-6-8-30(34)11-15-36-16-12-30)2-1-20(22(23)24)27-5-7-29(33)9-13-35-14-10-29/h1-4,17,27-28H,5-16H2