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5-(azepan-1-ium-1-yl)pentanoate

5-(azepan-1-ium-1-yl)pentanoate

Systemtic Name:5-(azepan-1-ium-1-yl)pentanoate
Openeye Name:5-(azepan-1-ium-1-yl)pentanoate
CAS Name:5-(1-azepan-1-iumyl)pentanoate
IUPAC Name:5-(azepan-1-ium-1-yl)pentanoate
Traditional Name:5-(azepan-1-ium-1-yl)valerate
Formula: C11H21NO2
MolecularWeight: 199.28994
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C11H21NO2/c13-11(14)7-3-6-10-12-8-4-1-2-5-9-12/h1-10H2,(H,13,14)


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