4-[5-[(tert-butylazaniumyl)methyl]furan-2-yl]benzoate

Systemtic Name: 4-[5-[(tert-butylazaniumyl)methyl]furan-2-yl]benzoate Openeye Name: 4-[5-[(tert-butylammonio)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(tert-butylammonio)methyl]-2-furanyl]benzoate IUPAC Name: 4-[5-[(tert-butylazaniumyl)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(tert-butylammonio)methyl]-2-furyl]benzoate Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC1=CC=C(O1)C2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)[NH2+]CC1=CC=C(O1)C2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C16H19NO3/c1-16(2,3)17-10-13-8-9-14(20-13)11-4-6-12(7-5-11)15(18)19/h4-9,17H,10H2,1-3H3,(H,18,19)