[3-methyl-1-(2-prop-2-enoxy-1-benzofuran-5-yl)butyl]sulfamic acid

Systemtic Name: [3-methyl-1-(2-prop-2-enoxy-1-benzofuran-5-yl)butyl]sulfamic acid Openeye Name: [1-(2-allyloxybenzofuran-5-yl)-3-methyl-butyl]sulfamic acid CAS Name: [3-methyl-1-(2-prop-2-enoxy-5-benzofuranyl)butyl]sulfamic acid IUPAC Name: [3-methyl-1-(2-prop-2-enoxy-1-benzofuran-5-yl)butyl]sulfamic acid Traditional Name: [1-(2-allyloxybenzofuran-5-yl)-3-methyl-butyl]sulfamic acid Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC2=C(C=C1)OC(=C2)OCC=C)NS(=O)(=O)O

Isomeric SMILES

CC(C)CC(C1=CC2=C(C=C1)OC(=C2)OCC=C)NS(=O)(=O)O

InChI

InChI=1S/C16H21NO5S/c1-4-7-21-16-10-13-9-12(5-6-15(13)22-16)14(8-11(2)3)17-23(18,19)20/h4-6,9-11,14,17H,1,7-8H2,2-3H3,(H,18,19,20)