cyclooctyl-[(5R)-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: cyclooctyl-[(5R)-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: cyclooctyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: cyclooctyl-[(5R)-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: cyclooctyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: cyclooctyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C24H43N5O+2 MolecularWeight: 417.63112

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH2+]C3CCCCCCC3)C(=N1)C(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH2+]C3CCCCCCC3)C(=N1)C(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C24H41N5O/c1-3-13-29-22-12-11-20(25-19-9-7-5-4-6-8-10-19)18-21(22)23(26-29)24(30)28-16-14-27(2)15-17-28/h19-20,25H,3-18H2,1-2H3/p+2/t20-/m1/s1