[2-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxidanylidene-butyl] 4-(4-butan-2-ylphenyl)sulfonylbenzoate

Systemtic Name: [2-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxidanylidene-butyl] 4-(4-butan-2-ylphenyl)sulfonylbenzoate Openeye Name: (2-tert-butoxycarbonyl-2-methyl-3-oxo-butyl) 4-(4-sec-butylphenyl)sulfonylbenzoate CAS Name: 4-(4-butan-2-ylphenyl)sulfonylbenzoic acid [2-methyl-2-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-oxobutyl] ester IUPAC Name: [2-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxobutyl] 4-(4-butan-2-ylphenyl)sulfonylbenzoate Traditional Name: 4-(4-sec-butylphenyl)sulfonylbenzoic acid (2-tert-butoxycarbonyl-3-keto-2-methyl-butyl) ester Formula: C27H34O7S MolecularWeight: 502.61966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(C)(C(=O)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(C)(C(=O)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H34O7S/c1-8-18(2)20-9-13-22(14-10-20)35(31,32)23-15-11-21(12-16-23)24(29)33-17-27(7,19(3)28)25(30)34-26(4,5)6/h9-16,18H,8,17H2,1-7H3