2-benzamido-3-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-5-yl)propanoic acid

Systemtic Name: 2-benzamido-3-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-5-yl)propanoic acid Openeye Name: 2-benzamido-3-(7-methoxy-2,2-dimethyl-3H-benzofuran-5-yl)propanoic acid CAS Name: 2-benzamido-3-(7-methoxy-2,2-dimethyl-3H-benzofuran-5-yl)propanoic acid IUPAC Name: 2-benzamido-3-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-5-yl)propanoic acid Traditional Name: 2-benzamido-3-(7-methoxy-2,2-dimethyl-coumaran-5-yl)propionic acid Formula: C21H23NO5 MolecularWeight: 369.41102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=CC(=C2O1)OC)CC(C(=O)O)NC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC2=CC(=CC(=C2O1)OC)CC(C(=O)O)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H23NO5/c1-21(2)12-15-9-13(11-17(26-3)18(15)27-21)10-16(20(24)25)22-19(23)14-7-5-4-6-8-14/h4-9,11,16H,10,12H2,1-3H3,(H,22,23)(H,24,25)