1-(1,3-benzodioxol-5-yl)-8-[(1-oxidanidylpyridin-1-ium-4-yl)carbonylamino]-4,5-dihydrobenzo[g]indazole-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-8-[(1-oxidanidylpyridin-1-ium-4-yl)carbonylamino]-4,5-dihydrobenzo[g]indazole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-8-[(1-oxidopyridin-1-ium-4-carbonyl)amino]-4,5-dihydrobenzo[g]indazole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-8-[[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]amino]-4,5-dihydrobenzo[g]indazole-3-carboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-8-[(1-oxidopyridin-1-ium-4-carbonyl)amino]-4,5-dihydrobenzo[g]indazole-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-8-[(1-oxidopyridin-1-ium-4-carbonyl)amino]-4,5-dihydrobenz[g]indazole-3-carboxamide Formula: C25H19N5O5 MolecularWeight: 469.44886

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=C1C=CC(=C3)NC(=O)C4=CC=[N+](C=C4)[O-])N(N=C2C(=O)N)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CC2=C(C3=C1C=CC(=C3)NC(=O)C4=CC=[N+](C=C4)[O-])N(N=C2C(=O)N)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C25H19N5O5/c26-24(31)22-18-5-2-14-1-3-16(27-25(32)15-7-9-29(33)10-8-15)11-19(14)23(18)30(28-22)17-4-6-20-21(12-17)35-13-34-20/h1,3-4,6-12H,2,5,13H2,(H2,26,31)(H,27,32)