4-[furan-2-ylmethyl(methyl)amino]benzoic acid

Systemtic Name: 4-[furan-2-ylmethyl(methyl)amino]benzoic acid Openeye Name: 4-[2-furylmethyl(methyl)amino]benzoic acid CAS Name: 4-[2-furanylmethyl(methyl)amino]benzoic acid IUPAC Name: 4-[furan-2-ylmethyl(methyl)amino]benzoic acid Traditional Name: 4-[2-furfuryl(methyl)amino]benzoic acid Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CO1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN(CC1=CC=CO1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H13NO3/c1-14(9-12-3-2-8-17-12)11-6-4-10(5-7-11)13(15)16/h2-8H,9H2,1H3,(H,15,16)