3-(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl)propanoylsulfamic acid

Systemtic Name: 3-(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl)propanoylsulfamic acid Openeye Name: 3-(2-ethoxy-3,3-dimethyl-2H-benzofuran-5-yl)propanoylsulfamic acid CAS Name: [3-(2-ethoxy-3,3-dimethyl-2H-benzofuran-5-yl)-1-oxopropyl]sulfamic acid IUPAC Name: 3-(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl)propanoylsulfamic acid Traditional Name: 3-(2-ethoxy-3,3-dimethyl-coumaran-5-yl)propanoylsulfamic acid Formula: C15H21NO6S MolecularWeight: 343.39534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(C2=C(O1)C=CC(=C2)CCC(=O)NS(=O)(=O)O)(C)C

Isomeric SMILES

CCOC1C(C2=C(O1)C=CC(=C2)CCC(=O)NS(=O)(=O)O)(C)C

InChI

InChI=1S/C15H21NO6S/c1-4-21-14-15(2,3)11-9-10(5-7-12(11)22-14)6-8-13(17)16-23(18,19)20/h5,7,9,14H,4,6,8H2,1-3H3,(H,16,17)(H,18,19,20)