S-[4-(3-bromanyl-7-methoxy-1-methyl-2-oxidanylidene-3,4-dihydronaphthalen-1-yl)butyl] ethanethioate

Systemtic Name: S-[4-(3-bromanyl-7-methoxy-1-methyl-2-oxidanylidene-3,4-dihydronaphthalen-1-yl)butyl] ethanethioate Openeye Name: S-[4-(3-bromo-7-methoxy-1-methyl-2-oxo-tetralin-1-yl)butyl] ethanethioate CAS Name: ethanethioic acid S-[4-(3-bromo-7-methoxy-1-methyl-2-oxo-3,4-dihydronaphthalen-1-yl)butyl] ester IUPAC Name: S-[4-(3-bromo-7-methoxy-1-methyl-2-oxo-3,4-dihydronaphthalen-1-yl)butyl] ethanethioate Traditional Name: ethanethioic acid S-[4-(3-bromo-2-keto-7-methoxy-1-methyl-tetralin-1-yl)butyl] ester Formula: C18H23BrO3S MolecularWeight: 399.34242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCC1(C2=C(CC(C1=O)Br)C=CC(=C2)OC)C

Isomeric SMILES

CC(=O)SCCCCC1(C2=C(CC(C1=O)Br)C=CC(=C2)OC)C

InChI

InChI=1S/C18H23BrO3S/c1-12(20)23-9-5-4-8-18(2)15-11-14(22-3)7-6-13(15)10-16(19)17(18)21/h6-7,11,16H,4-5,8-10H2,1-3H3