[(5R)-1-methyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-[(1-oxidanylcyclohexyl)methyl]azanium

Systemtic Name: [(5R)-1-methyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-[(1-oxidanylcyclohexyl)methyl]azanium Openeye Name: (1-hydroxycyclohexyl)methyl-[(5R)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: (1-hydroxycyclohexyl)methyl-[(5R)-1-methyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: (1-hydroxycyclohexyl)methyl-[(5R)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: (1-hydroxycyclohexyl)methyl-[(5R)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C21H35N4O2+ MolecularWeight: 375.5282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH2+]CC3(CCCCC3)O)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

CN1C2=C(C[C@@H](CC2)[NH2+]CC3(CCCCC3)O)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C21H34N4O2/c1-24-18-9-8-16(22-15-21(27)10-4-2-5-11-21)14-17(18)19(23-24)20(26)25-12-6-3-7-13-25/h16,22,27H,2-15H2,1H3/p+1/t16-/m1/s1