2-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[3,5-dimethyl-1-(p-tolylmethyl)pyrazole-4-carbonyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[[3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carbonyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[3,5-dimethyl-1-(4-methylbenzyl)pyrazole-4-carbonyl]amino]ethyl-diisopropyl-ammonium Formula: C22H35N4O+ MolecularWeight: 371.5395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NCC[NH+](C(C)C)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NCC[NH+](C(C)C)C(C)C)C

InChI

InChI=1S/C22H34N4O/c1-15(2)25(16(3)4)13-12-23-22(27)21-18(6)24-26(19(21)7)14-20-10-8-17(5)9-11-20/h8-11,15-16H,12-14H2,1-7H3,(H,23,27)/p+1