(3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-(ethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-(ethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[2-(ethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(ethylamino)-2-oxoethyl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[2-(ethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(ethylamino)-2-keto-ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H23NO4S MolecularWeight: 337.43382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CCNC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C17H23NO4S/c1-5-18-15(20)11-23-13-9-7-6-8-12(13)16(21)22-10-14(19)17(2,3)4/h6-9H,5,10-11H2,1-4H3,(H,18,20)