2-(7-bromanyl-9H-thioxanthen-2-yl)propyl ethanoate

Systemtic Name: 2-(7-bromanyl-9H-thioxanthen-2-yl)propyl ethanoate Openeye Name: 2-(7-bromo-9H-thioxanthen-2-yl)propyl acetate CAS Name: acetic acid 2-(7-bromo-9H-thioxanthen-2-yl)propyl ester IUPAC Name: 2-(7-bromo-9H-thioxanthen-2-yl)propyl acetate Traditional Name: acetic acid 2-(7-bromo-9H-thioxanthen-2-yl)propyl ester Formula: C18H17BrO2S MolecularWeight: 377.29538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C)C1=CC2=C(C=C1)SC3=C(C2)C=C(C=C3)Br

Isomeric SMILES

CC(COC(=O)C)C1=CC2=C(C=C1)SC3=C(C2)C=C(C=C3)Br

InChI

InChI=1S/C18H17BrO2S/c1-11(10-21-12(2)20)13-3-5-17-14(7-13)8-15-9-16(19)4-6-18(15)22-17/h3-7,9,11H,8,10H2,1-2H3