2-cyanoethyl-methyl-[(3S)-2-oxidanylideneazepan-3-yl]azanium

Systemtic Name: 2-cyanoethyl-methyl-[(3S)-2-oxidanylideneazepan-3-yl]azanium Openeye Name: 2-cyanoethyl-methyl-[(3S)-2-oxoazepan-3-yl]ammonium CAS Name: 2-cyanoethyl-methyl-[(3S)-2-oxo-3-azepanyl]ammonium IUPAC Name: 2-cyanoethyl-methyl-[(3S)-2-oxoazepan-3-yl]azanium Traditional Name: 2-cyanoethyl-[(3S)-2-ketoazepan-3-yl]-methyl-ammonium Formula: C10H18N3O+ MolecularWeight: 196.26942

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC#N)C1CCCCNC1=O

Isomeric SMILES

C[NH+](CCC#N)[C@H]1CCCCNC1=O

InChI

InChI=1S/C10H17N3O/c1-13(8-4-6-11)9-5-2-3-7-12-10(9)14/h9H,2-5,7-8H2,1H3,(H,12,14)/p+1/t9-/m0/s1