2-acetamidoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium

Systemtic Name: 2-acetamidoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium Openeye Name: 2-acetamidoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium CAS Name: 2-acetamidoethyl-[(1,3-diphenyl-4-pyrazolyl)methyl]-methylammonium IUPAC Name: 2-acetamidoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methylazanium Traditional Name: 2-acetamidoethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium Formula: C21H25N4O+ MolecularWeight: 349.4494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O/c1-17(26)22-13-14-24(2)15-19-16-25(20-11-7-4-8-12-20)23-21(19)18-9-5-3-6-10-18/h3-12,16H,13-15H2,1-2H3,(H,22,26)/p+1