1,4-diazepan-4-ium-1-yl-(1,5-dimethylpyrazol-4-yl)methanone

Systemtic Name: 1,4-diazepan-4-ium-1-yl-(1,5-dimethylpyrazol-4-yl)methanone Openeye Name: 1,4-diazepan-4-ium-1-yl-(1,5-dimethylpyrazol-4-yl)methanone CAS Name: 1,4-diazepan-4-ium-1-yl-(1,5-dimethyl-4-pyrazolyl)methanone IUPAC Name: 1,4-diazepan-4-ium-1-yl-(1,5-dimethylpyrazol-4-yl)methanone Traditional Name: 1,4-diazepan-4-ium-1-yl-(1,5-dimethylpyrazol-4-yl)methanone Formula: C11H19N4O+ MolecularWeight: 223.29476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)N2CCC[NH2+]CC2

Isomeric SMILES

CC1=C(C=NN1C)C(=O)N2CCC[NH2+]CC2

InChI

InChI=1S/C11H18N4O/c1-9-10(8-13-14(9)2)11(16)15-6-3-4-12-5-7-15/h8,12H,3-7H2,1-2H3/p+1