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

Systemtic Name: [5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyl]ammonium CAS Name: [5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methyl]azanium Traditional Name: benzyl-[(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyl]ammonium Formula: C16H23ClN3+ MolecularWeight: 292.82692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH2+]CC2=CC=CC=C2)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C[NH2+]CC2=CC=CC=C2)Cl)CC(C)C

InChI

InChI=1S/C16H22ClN3/c1-12(2)11-20-16(17)15(13(3)19-20)10-18-9-14-7-5-4-6-8-14/h4-8,12,18H,9-11H2,1-3H3/p+1