ethyl 4-(3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium-5-yl)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium-5-yl)piperidine-1-carboxylate Openeye Name: ethyl 4-(3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium-5-yl)piperidine-1-carboxylate CAS Name: 4-(3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium-5-yl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium-5-yl)piperidine-1-carboxylate Traditional Name: 4-(3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium-5-yl)piperidine-1-carboxylic acid ethyl ester Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH+]2CCC3=C(C2)C(=NN3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH+]2CCC3=C(C2)C(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C20H26N4O2/c1-2-26-20(25)23-11-8-16(9-12-23)24-13-10-18-17(14-24)19(22-21-18)15-6-4-3-5-7-15/h3-7,16H,2,8-14H2,1H3,(H,21,22)/p+1