(1-methylpyrazol-4-yl)methyl-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium

Systemtic Name: (1-methylpyrazol-4-yl)methyl-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium Openeye Name: (1-methylpyrazol-4-yl)methyl-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]ammonium CAS Name: (1-methyl-4-pyrazolyl)methyl-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]ammonium IUPAC Name: (1-methylpyrazol-4-yl)methyl-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]azanium Traditional Name: [4-(2-ketopyrrolidino)benzyl]-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH2+]CC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CN1C=C(C=N1)C[NH2+]CC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C16H20N4O/c1-19-12-14(11-18-19)10-17-9-13-4-6-15(7-5-13)20-8-2-3-16(20)21/h4-7,11-12,17H,2-3,8-10H2,1H3/p+1