4-methoxy-1,4-dimethyl-1-oxidanidyl-azepan-1-ium

Systemtic Name: 4-methoxy-1,4-dimethyl-1-oxidanidyl-azepan-1-ium Openeye Name: 4-methoxy-1,4-dimethyl-1-oxido-azepan-1-ium CAS Name: 4-methoxy-1,4-dimethyl-1-oxidoazepan-1-ium IUPAC Name: 4-methoxy-1,4-dimethyl-1-oxidoazepan-1-ium Traditional Name: 4-methoxy-1,4-dimethyl-1-oxido-azepan-1-ium Formula: C9H19NO2 MolecularWeight: 173.25266

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC[N+](CC1)(C)[O-])OC

Isomeric SMILES

CC1(CCC[N+](CC1)(C)[O-])OC

InChI

InChI=1S/C9H19NO2/c1-9(12-3)5-4-7-10(2,11)8-6-9/h4-8H2,1-3H3