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

Systemtic Name: butyl-[(5S)-1-ethyl-3-(methylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]-methyl-azanium Openeye Name: butyl-[(5S)-1-ethyl-3-(methylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]-methyl-ammonium CAS Name: butyl-[(5S)-1-ethyl-3-(methylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]-methylammonium IUPAC Name: butyl-[(5S)-1-ethyl-3-(methylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]-methylazanium Traditional Name: butyl-[(5S)-1-ethyl-3-(methylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]-methyl-ammonium Formula: C16H29N4O+ MolecularWeight: 293.42766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N4O/c1-5-7-10-19(4)12-8-9-14-13(11-12)15(16(21)17-3)18-20(14)6-2/h12H,5-11H2,1-4H3,(H,17,21)/p+1/t12-/m0/s1