4-[[(5-methylfuran-2-yl)methylamino]methyl]benzoic acid

Systemtic Name: 4-[[(5-methylfuran-2-yl)methylamino]methyl]benzoic acid Openeye Name: 4-[[(5-methyl-2-furyl)methylamino]methyl]benzoic acid CAS Name: 4-[[(5-methyl-2-furanyl)methylamino]methyl]benzoic acid IUPAC Name: 4-[[(5-methylfuran-2-yl)methylamino]methyl]benzoic acid Traditional Name: 4-[[(5-methyl-2-furyl)methylamino]methyl]benzoic acid Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(O1)CNCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H15NO3/c1-10-2-7-13(18-10)9-15-8-11-3-5-12(6-4-11)14(16)17/h2-7,15H,8-9H2,1H3,(H,16,17)