(6-methylidene-1,4-dithiepan-2-yl)methyl (E)-4-oxidanylidene-4-(3-trimethoxysilylpropylamino)but-2-enoate

Systemtic Name: (6-methylidene-1,4-dithiepan-2-yl)methyl (E)-4-oxidanylidene-4-(3-trimethoxysilylpropylamino)but-2-enoate Openeye Name: (6-methylene-1,4-dithiepan-2-yl)methyl (E)-4-oxo-4-(3-trimethoxysilylpropylamino)but-2-enoate CAS Name: (E)-4-oxo-4-(3-trimethoxysilylpropylamino)-2-butenoic acid (6-methylene-1,4-dithiepan-2-yl)methyl ester IUPAC Name: (6-methylidene-1,4-dithiepan-2-yl)methyl (E)-4-oxo-4-(3-trimethoxysilylpropylamino)but-2-enoate Traditional Name: (E)-4-keto-4-(3-trimethoxysilylpropylamino)but-2-enoic acid (6-methylene-1,4-dithiepan-2-yl)methyl ester Formula: C17H29NO6S2Si MolecularWeight: 435.63076

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Descriptors Computed from Structure

Canonical SMILES:

CO[Si](CCCNC(=O)C=CC(=O)OCC1CSCC(=C)CS1)(OC)OC

Isomeric SMILES

CO[Si](CCCNC(=O)/C=C/C(=O)OCC1CSCC(=C)CS1)(OC)OC

InChI

InChI=1S/C17H29NO6S2Si/c1-14-11-25-13-15(26-12-14)10-24-17(20)7-6-16(19)18-8-5-9-27(21-2,22-3)23-4/h6-7,15H,1,5,8-13H2,2-4H3,(H,18,19)/b7-6+