3-methyl-2-oxidanyl-5-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-methyl-2-oxidanyl-5-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-hydroxy-3-methyl-5-[[(E)-3-(5-phenyl-2-furyl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-hydroxy-3-methyl-5-[[(E)-1-oxo-3-(5-phenyl-2-furanyl)prop-2-enyl]amino]benzoic acid IUPAC Name: 2-hydroxy-3-methyl-5-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-hydroxy-3-methyl-5-[[(E)-3-(5-phenyl-2-furyl)acryloyl]amino]benzoic acid Formula: C21H17NO5 MolecularWeight: 363.36338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3)C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3)C(=O)O)O

InChI

InChI=1S/C21H17NO5/c1-13-11-15(12-17(20(13)24)21(25)26)22-19(23)10-8-16-7-9-18(27-16)14-5-3-2-4-6-14/h2-12,24H,1H3,(H,22,23)(H,25,26)/b10-8+