[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyl-(3-isopropoxypropyl)ammonium CAS Name: [5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyl-(3-isopropoxypropyl)ammonium Formula: C15H29ClN3O+ MolecularWeight: 302.86326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH2+]CCCOC(C)C)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C[NH2+]CCCOC(C)C)Cl)CC(C)C

InChI

InChI=1S/C15H28ClN3O/c1-11(2)10-19-15(16)14(13(5)18-19)9-17-7-6-8-20-12(3)4/h11-12,17H,6-10H2,1-5H3/p+1