4-(3-ethoxy-2,2-dimethyl-3-oxidanylidene-propyl)benzenethiolate

Systemtic Name: 4-(3-ethoxy-2,2-dimethyl-3-oxidanylidene-propyl)benzenethiolate Openeye Name: 4-(3-ethoxy-2,2-dimethyl-3-oxo-propyl)benzenethiolate CAS Name: 4-(3-ethoxy-2,2-dimethyl-3-oxopropyl)benzenethiolate IUPAC Name: 4-(3-ethoxy-2,2-dimethyl-3-oxopropyl)benzenethiolate Traditional Name: 4-(3-ethoxy-3-keto-2,2-dimethyl-propyl)benzenethiolate Formula: C13H17O2S- MolecularWeight: 237.33788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CC1=CC=C(C=C1)[S-]

Isomeric SMILES

CCOC(=O)C(C)(C)CC1=CC=C(C=C1)[S-]

InChI

InChI=1S/C13H18O2S/c1-4-15-12(14)13(2,3)9-10-5-7-11(16)8-6-10/h5-8,16H,4,9H2,1-3H3/p-1