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5-[(butylazaniumyl)methyl]furan-2-carboxylate

5-[(butylazaniumyl)methyl]furan-2-carboxylate

Systemtic Name:5-[(butylazaniumyl)methyl]furan-2-carboxylate
Openeye Name:5-[(butylammonio)methyl]furan-2-carboxylate
CAS Name:5-[(butylammonio)methyl]-2-furancarboxylate
IUPAC Name:5-[(butylazaniumyl)methyl]furan-2-carboxylate
Traditional Name:5-[(butylammonio)methyl]-2-furoate
Formula: C10H15NO3
MolecularWeight: 197.231
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=CC=C(O1)C(=O)[O-]


Isomeric SMILES

CCCC[NH2+]CC1=CC=C(O1)C(=O)[O-]


InChI

InChI=1S/C10H15NO3/c1-2-3-6-11-7-8-4-5-9(14-8)10(12)13/h4-5,11H,2-3,6-7H2,1H3,(H,12,13)


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