5-[[(3-carboxy-2-methyl-phenyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[(3-carboxy-2-methyl-phenyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[(3-carboxy-2-methyl-anilino)methyl]furan-2-carboxylic acid CAS Name: 5-[(3-carboxy-2-methylanilino)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(3-carboxy-2-methylanilino)methyl]furan-2-carboxylic acid Traditional Name: 5-[(3-carboxy-2-methyl-anilino)methyl]-2-furoic acid Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=CC=C(O2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NCC2=CC=C(O2)C(=O)O)C(=O)O

InChI

InChI=1S/C14H13NO5/c1-8-10(13(16)17)3-2-4-11(8)15-7-9-5-6-12(20-9)14(18)19/h2-6,15H,7H2,1H3,(H,16,17)(H,18,19)