2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-amino]-3-triethylsilyloxy-butanoic acid

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-amino]-3-triethylsilyloxy-butanoic acid Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-amino]-3-triethylsilyloxy-butanoic acid CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-3-triethylsilyloxybutanoic acid IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-3-triethylsilyloxybutanoic acid Traditional Name: 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-piperonyl-amino]-3-triethylsilyloxy-butyric acid Formula: C28H41NO8SSi MolecularWeight: 579.77754

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Descriptors Computed from Structure

Canonical SMILES:

CC[Si](CC)(CC)OC(C)C(C(=O)O)N(CC1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=C(C(=C(C=C3C)OC)C)C

Isomeric SMILES

CC[Si](CC)(CC)OC(C)C(C(=O)O)N(CC1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=C(C(=C(C=C3C)OC)C)C

InChI

InChI=1S/C28H41NO8SSi/c1-9-39(10-2,11-3)37-21(7)26(28(30)31)29(16-22-12-13-23-25(15-22)36-17-35-23)38(32,33)27-18(4)14-24(34-8)19(5)20(27)6/h12-15,21,26H,9-11,16-17H2,1-8H3,(H,30,31)