1,4-diazepan-4-ium-1-yl-(3,5-dimethyl-1,2-oxazol-4-yl)methanone

Systemtic Name: 1,4-diazepan-4-ium-1-yl-(3,5-dimethyl-1,2-oxazol-4-yl)methanone Openeye Name: 1,4-diazepan-4-ium-1-yl-(3,5-dimethylisoxazol-4-yl)methanone CAS Name: 1,4-diazepan-4-ium-1-yl-(3,5-dimethyl-4-isoxazolyl)methanone IUPAC Name: 1,4-diazepan-4-ium-1-yl-(3,5-dimethyl-1,2-oxazol-4-yl)methanone Traditional Name: 1,4-diazepan-4-ium-1-yl-(3,5-dimethylisoxazol-4-yl)methanone Formula: C11H18N3O2+ MolecularWeight: 224.27952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CCC[NH2+]CC2

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CCC[NH2+]CC2

InChI

InChI=1S/C11H17N3O2/c1-8-10(9(2)16-13-8)11(15)14-6-3-4-12-5-7-14/h12H,3-7H2,1-2H3/p+1