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2-azaniumyl-2-phenyl-heptanoate

2-azaniumyl-2-phenyl-heptanoate

Systemtic Name:2-azaniumyl-2-phenyl-heptanoate
Openeye Name:2-azaniumyl-2-phenyl-heptanoate
CAS Name:2-ammonio-2-phenylheptanoate
IUPAC Name:2-azaniumyl-2-phenylheptanoate
Traditional Name:2-ammonio-2-phenyl-enanthate
Formula: C13H19NO2
MolecularWeight: 221.29546
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC=C1)(C(=O)[O-])[NH3+]


Isomeric SMILES

CCCCCC(C1=CC=CC=C1)(C(=O)[O-])[NH3+]


InChI

InChI=1S/C13H19NO2/c1-2-3-7-10-13(14,12(15)16)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10,14H2,1H3,(H,15,16)


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