methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: methyl-[2-(4-methylanilino)-2-oxo-ethyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: methyl-[2-(4-methylanilino)-2-oxoethyl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: methyl-[2-(4-methylanilino)-2-oxoethyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: [2-keto-2-(p-toluidino)ethyl]-methyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O/c1-16-8-10-18(11-9-16)22-20(25)15-23(2)13-17-12-21-24(14-17)19-6-4-3-5-7-19/h3-12,14H,13,15H2,1-2H3,(H,22,25)/p+1