butyl-[(5S)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-methyl-azanium

Systemtic Name: butyl-[(5S)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-methyl-azanium Openeye Name: butyl-[(5S)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-methyl-ammonium CAS Name: butyl-[(5S)-1-ethyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-methylammonium IUPAC Name: butyl-[(5S)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-methylazanium Traditional Name: butyl-[(5S)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-methyl-ammonium Formula: C20H35N4O+ MolecularWeight: 347.5181

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C1CCC2=C(C1)C(=NN2CC)C(=O)N3CCCCC3

Isomeric SMILES

CCCC[NH+](C)[C@H]1CCC2=C(C1)C(=NN2CC)C(=O)N3CCCCC3

InChI

InChI=1S/C20H34N4O/c1-4-6-12-22(3)16-10-11-18-17(15-16)19(21-24(18)5-2)20(25)23-13-8-7-9-14-23/h16H,4-15H2,1-3H3/p+1/t16-/m0/s1