[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]phenyl]methyl-(3-methylbutyl)azanium

Systemtic Name: [4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]phenyl]methyl-(3-methylbutyl)azanium Openeye Name: [4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]phenyl]methyl-isopentyl-ammonium CAS Name: [4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]phenyl]methyl-(3-methylbutyl)ammonium IUPAC Name: [4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]phenyl]methyl-(3-methylbutyl)azanium Traditional Name: isoamyl-[4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]benzyl]ammonium Formula: C23H31N4O+ MolecularWeight: 379.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=C(C=C3)C[NH2+]CCC(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=C(C=C3)C[NH2+]CCC(C)C

InChI

InChI=1S/C23H30N4O/c1-17(2)14-15-24-16-19-10-12-20(13-11-19)25-22-18(3)26(4)27(23(22)28)21-8-6-5-7-9-21/h5-13,17,24-25H,14-16H2,1-4H3/p+1