5-[[(phenylmethyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[(phenylmethyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[(benzylamino)methyl]furan-2-carboxylic acid CAS Name: 5-[[(phenylmethyl)amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[(benzylamino)methyl]furan-2-carboxylic acid Traditional Name: 5-[(benzylamino)methyl]-2-furoic acid Formula: C13H13NO3 MolecularWeight: 231.24722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC2=CC=C(O2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNCC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C13H13NO3/c15-13(16)12-7-6-11(17-12)9-14-8-10-4-2-1-3-5-10/h1-7,14H,8-9H2,(H,15,16)