5-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indole-2-sulfinate

Systemtic Name: 5-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indole-2-sulfinate Openeye Name: 1-tert-butoxycarbonyl-5-methoxy-indole-2-sulfinate CAS Name: 5-methoxy-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-indolesulfinate IUPAC Name: 5-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indole-2-sulfinate Traditional Name: 1-tert-butoxycarbonyl-5-methoxy-indole-2-sulfinate Formula: C14H16NO5S- MolecularWeight: 310.34554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)OC)C=C1S(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)OC)C=C1S(=O)[O-]

InChI

InChI=1S/C14H17NO5S/c1-14(2,3)20-13(16)15-11-6-5-10(19-4)7-9(11)8-12(15)21(17)18/h5-8H,1-4H3,(H,17,18)/p-1