4-azanyl-5-methyl-2-[2-(3-methyl-1H-imidazol-3-ium-2-yl)ethyl]-1H-pyrazol-3-one

Systemtic Name: 4-azanyl-5-methyl-2-[2-(3-methyl-1H-imidazol-3-ium-2-yl)ethyl]-1H-pyrazol-3-one Openeye Name: 4-amino-5-methyl-2-[2-(3-methyl-1H-imidazol-3-ium-2-yl)ethyl]-1H-pyrazol-3-one CAS Name: 4-amino-5-methyl-2-[2-(3-methyl-1H-imidazol-3-ium-2-yl)ethyl]-1H-pyrazol-3-one IUPAC Name: 4-amino-5-methyl-2-[2-(3-methyl-1H-imidazol-3-ium-2-yl)ethyl]-1H-pyrazol-3-one Traditional Name: 4-amino-5-methyl-2-[2-(3-methyl-1H-imidazol-3-ium-2-yl)ethyl]-3-pyrazolin-3-one Formula: C10H16N5O+ MolecularWeight: 222.26694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)CCC2=[N+](C=CN2)C)N

Isomeric SMILES

CC1=C(C(=O)N(N1)CCC2=[N+](C=CN2)C)N

InChI

InChI=1S/C10H15N5O/c1-7-9(11)10(16)15(13-7)5-3-8-12-4-6-14(8)2/h4,6H,3,5,11H2,1-2H3,(H,13,16)/p+1