4-[3-(5-methylfuran-2-yl)but-2-enoylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[3-(5-methylfuran-2-yl)but-2-enoylamino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[3-(5-methyl-2-furyl)but-2-enoylamino]benzoic acid CAS Name: 2-hydroxy-4-[[3-(5-methyl-2-furanyl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 2-hydroxy-4-[3-(5-methylfuran-2-yl)but-2-enoylamino]benzoic acid Traditional Name: 2-hydroxy-4-[3-(5-methyl-2-furyl)but-2-enoylamino]benzoic acid Formula: C16H15NO5 MolecularWeight: 301.294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=CC(=O)NC2=CC(=C(C=C2)C(=O)O)O)C

Isomeric SMILES

CC1=CC=C(O1)C(=CC(=O)NC2=CC(=C(C=C2)C(=O)O)O)C

InChI

InChI=1S/C16H15NO5/c1-9(14-6-3-10(2)22-14)7-15(19)17-11-4-5-12(16(20)21)13(18)8-11/h3-8,18H,1-2H3,(H,17,19)(H,20,21)