(6-methylidene-1,4-dithiepan-2-yl)methyl 2-(3-triethoxysilylpropylcarbamoyl)benzoate

Systemtic Name: (6-methylidene-1,4-dithiepan-2-yl)methyl 2-(3-triethoxysilylpropylcarbamoyl)benzoate Openeye Name: (6-methylene-1,4-dithiepan-2-yl)methyl 2-(3-triethoxysilylpropylcarbamoyl)benzoate CAS Name: 2-[oxo-(3-triethoxysilylpropylamino)methyl]benzoic acid (6-methylene-1,4-dithiepan-2-yl)methyl ester IUPAC Name: (6-methylidene-1,4-dithiepan-2-yl)methyl 2-(3-triethoxysilylpropylcarbamoyl)benzoate Traditional Name: 2-(3-triethoxysilylpropylcarbamoyl)benzoic acid (6-methylene-1,4-dithiepan-2-yl)methyl ester Formula: C24H37NO6S2Si MolecularWeight: 527.76918

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Descriptors Computed from Structure

Canonical SMILES:

CCO[Si](CCCNC(=O)C1=CC=CC=C1C(=O)OCC2CSCC(=C)CS2)(OCC)OCC

Isomeric SMILES

CCO[Si](CCCNC(=O)C1=CC=CC=C1C(=O)OCC2CSCC(=C)CS2)(OCC)OCC

InChI

InChI=1S/C24H37NO6S2Si/c1-5-29-34(30-6-2,31-7-3)14-10-13-25-23(26)21-11-8-9-12-22(21)24(27)28-15-20-18-32-16-19(4)17-33-20/h8-9,11-12,20H,4-7,10,13-18H2,1-3H3,(H,25,26)