1-[4-[(5R)-3-piperidin-1-ylcarbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[(5R)-3-piperidin-1-ylcarbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(5R)-3-(piperidine-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[(5R)-3-[oxo(1-piperidinyl)methyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[(5R)-3-(piperidine-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[(5R)-3-(piperidine-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]piperazin-4-ium-1-yl]ethanone Formula: C22H36N5O2+ MolecularWeight: 402.55354

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH+]3CCN(CC3)C(=O)C)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH+]3CCN(CC3)C(=O)C)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C22H35N5O2/c1-3-9-27-20-8-7-18(25-14-12-24(13-15-25)17(2)28)16-19(20)21(23-27)22(29)26-10-5-4-6-11-26/h18H,3-16H2,1-2H3/p+1/t18-/m1/s1