(1,3-diphenylpyrazol-4-yl)methyl-methyl-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-methyl-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]ammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]azanium Traditional Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-keto-2-(4-methylpiperidino)ethyl]-methyl-ammonium Formula: C25H31N4O+ MolecularWeight: 403.53984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C[NH+](C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C(=O)C[NH+](C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O/c1-20-13-15-28(16-14-20)24(30)19-27(2)17-22-18-29(23-11-7-4-8-12-23)26-25(22)21-9-5-3-6-10-21/h3-12,18,20H,13-17,19H2,1-2H3/p+1