5-[(propan-2-ylazaniumyl)methyl]furan-2-carboxylate

Systemtic Name: 5-[(propan-2-ylazaniumyl)methyl]furan-2-carboxylate Openeye Name: 5-[(isopropylammonio)methyl]furan-2-carboxylate CAS Name: 5-[(propan-2-ylammonio)methyl]-2-furancarboxylate IUPAC Name: 5-[(propan-2-ylazaniumyl)methyl]furan-2-carboxylate Traditional Name: 5-[(isopropylammonio)methyl]-2-furoate Formula: C9H13NO3 MolecularWeight: 183.20442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO3/c1-6(2)10-5-7-3-4-8(13-7)9(11)12/h3-4,6,10H,5H2,1-2H3,(H,11,12)