2-cyclohexyl-5-methyl-4-phenyl-1H-pyrazol-2-ium-3-amine

Systemtic Name: 2-cyclohexyl-5-methyl-4-phenyl-1H-pyrazol-2-ium-3-amine Openeye Name: 2-cyclohexyl-5-methyl-4-phenyl-1H-pyrazol-2-ium-3-amine CAS Name: 2-cyclohexyl-5-methyl-4-phenyl-1H-pyrazol-2-ium-3-amine IUPAC Name: 2-cyclohexyl-5-methyl-4-phenyl-1H-pyrazol-2-ium-3-amine Traditional Name: (2-cyclohexyl-5-methyl-4-phenyl-1H-pyrazol-2-ium-3-yl)amine Formula: C16H22N3+ MolecularWeight: 256.36598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](N1)C2CCCCC2)N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=[N+](N1)C2CCCCC2)N)C3=CC=CC=C3

InChI

InChI=1S/C16H21N3/c1-12-15(13-8-4-2-5-9-13)16(17)19(18-12)14-10-6-3-7-11-14/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3,(H2,17,18)/p+1