N,N-dimethyl-3-[1-oxidanidyl-4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-1-ium-7-yl]oxy-propan-1-amine

Systemtic Name: N,N-dimethyl-3-[1-oxidanidyl-4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-1-ium-7-yl]oxy-propan-1-amine Openeye Name: N,N-dimethyl-3-[1-oxido-4-[2-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinolin-1-ium-7-yl]oxy-propan-1-amine CAS Name: N,N-dimethyl-3-[[1-oxido-4-[2-(2-pyridinyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-7-quinolin-1-iumyl]oxy]-1-propanamine IUPAC Name: N,N-dimethyl-3-[1-oxido-4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-1-ium-7-yl]oxypropan-1-amine Traditional Name: dimethyl-[3-[1-oxido-4-[2-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinolin-1-ium-7-yl]oxypropyl]amine Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CC2=[N+](C=CC(=C2C=C1)C3=C4CCCN4N=C3C5=CC=CC=N5)[O-]

Isomeric SMILES

CN(C)CCCOC1=CC2=[N+](C=CC(=C2C=C1)C3=C4CCCN4N=C3C5=CC=CC=N5)[O-]

InChI

InChI=1S/C25H27N5O2/c1-28(2)13-6-16-32-18-9-10-19-20(11-15-30(31)23(19)17-18)24-22-8-5-14-29(22)27-25(24)21-7-3-4-12-26-21/h3-4,7,9-12,15,17H,5-6,8,13-14,16H2,1-2H3