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

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]azanium Traditional Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-keto-2-(propylamino)ethyl]-methyl-ammonium Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)C[NH+](C)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O/c1-3-14-23-21(27)17-25(2)15-19-16-26(20-12-8-5-9-13-20)24-22(19)18-10-6-4-7-11-18/h4-13,16H,3,14-15,17H2,1-2H3,(H,23,27)/p+1