[(5S)-1-methyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-methylpropyl)azanium

Systemtic Name: [(5S)-1-methyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-methylpropyl)azanium Openeye Name: isobutyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: [(5S)-1-methyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-(2-methylpropyl)ammonium IUPAC Name: [(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(2-methylpropyl)azanium Traditional Name: isobutyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C18H31N4O+ MolecularWeight: 319.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]C1CCC2=C(C1)C(=NN2C)C(=O)N3CCCCC3

Isomeric SMILES

CC(C)C[NH2+][C@H]1CCC2=C(C1)C(=NN2C)C(=O)N3CCCCC3

InChI

InChI=1S/C18H30N4O/c1-13(2)12-19-14-7-8-16-15(11-14)17(20-21(16)3)18(23)22-9-5-4-6-10-22/h13-14,19H,4-12H2,1-3H3/p+1/t14-/m0/s1