4-(azepan-1-ium-1-yl)butanoate

Systemtic Name: 4-(azepan-1-ium-1-yl)butanoate Openeye Name: 4-(azepan-1-ium-1-yl)butanoate CAS Name: 4-(1-azepan-1-iumyl)butanoate IUPAC Name: 4-(azepan-1-ium-1-yl)butanoate Traditional Name: 4-(azepan-1-ium-1-yl)butyrate Formula: C10H19NO2 MolecularWeight: 185.26336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCC(=O)[O-]

Isomeric SMILES

C1CCC[NH+](CC1)CCCC(=O)[O-]

InChI

InChI=1S/C10H19NO2/c12-10(13)6-5-9-11-7-3-1-2-4-8-11/h1-9H2,(H,12,13)