methyl-[2-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-(2-phenoxyethyl)azanium

Systemtic Name: methyl-[2-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-(2-phenoxyethyl)azanium Openeye Name: methyl-[2-[[5-methyl-2-(p-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-(2-phenoxyethyl)ammonium CAS Name: methyl-[2-[[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-(2-phenoxyethyl)ammonium IUPAC Name: methyl-[2-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-(2-phenoxyethyl)azanium Traditional Name: [2-keto-2-[[5-methyl-2-(p-tolyl)pyrazol-3-yl]amino]ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)C[NH+](C)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)C[NH+](C)CCOC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2/c1-17-9-11-19(12-10-17)26-21(15-18(2)24-26)23-22(27)16-25(3)13-14-28-20-7-5-4-6-8-20/h4-12,15H,13-14,16H2,1-3H3,(H,23,27)/p+1