2,2-dimethyl-1-[4-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethoxy]phenyl]-3-sulfanyl-propan-1-one

Systemtic Name: 2,2-dimethyl-1-[4-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethoxy]phenyl]-3-sulfanyl-propan-1-one Openeye Name: 2,2-dimethyl-1-[4-[2-[4-(3-oxobutyl)phenoxy]ethoxy]phenyl]-3-sulfanyl-propan-1-one CAS Name: 3-mercapto-2,2-dimethyl-1-[4-[2-[4-(3-oxobutyl)phenoxy]ethoxy]phenyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[4-[2-[4-(3-oxobutyl)phenoxy]ethoxy]phenyl]-3-sulfanylpropan-1-one Traditional Name: 1-[4-[2-[4-(3-ketobutyl)phenoxy]ethoxy]phenyl]-3-mercapto-2,2-dimethyl-propan-1-one Formula: C23H28O4S MolecularWeight: 400.53102

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)C(C)(C)CS

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)C(C)(C)CS

InChI

InChI=1S/C23H28O4S/c1-17(24)4-5-18-6-10-20(11-7-18)26-14-15-27-21-12-8-19(9-13-21)22(25)23(2,3)16-28/h6-13,28H,4-5,14-16H2,1-3H3