2-[3-ethoxycarbonyl-5-[(1-methylbenzimidazol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-ethoxycarbonyl-5-[(1-methylbenzimidazol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[3-ethoxycarbonyl-5-[(1-methylbenzimidazol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[3-ethoxycarbonyl-5-[(1-methyl-2-benzimidazolyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[3-ethoxycarbonyl-5-[(1-methylbenzimidazol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[3-carbethoxy-5-[(1-methylbenzimidazol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]ethyl-dimethyl-ammonium Formula: C22H31N6O2+ MolecularWeight: 411.52054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CN(CC2)CC3=NC4=CC=CC=C4N3C)CC[NH+](C)C

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(CC2)CC3=NC4=CC=CC=C4N3C)CC[NH+](C)C

InChI

InChI=1S/C22H30N6O2/c1-5-30-22(29)21-16-14-27(11-10-18(16)28(24-21)13-12-25(2)3)15-20-23-17-8-6-7-9-19(17)26(20)4/h6-9H,5,10-15H2,1-4H3/p+1