[4-acetyloxy-8-(3-chlorophenyl)sulfanyl-3-methoxy-naphthalen-1-yl] ethanoate

Systemtic Name: [4-acetyloxy-8-(3-chlorophenyl)sulfanyl-3-methoxy-naphthalen-1-yl] ethanoate Openeye Name: [4-acetoxy-8-(3-chlorophenyl)sulfanyl-3-methoxy-1-naphthyl] acetate CAS Name: acetic acid [4-acetyloxy-8-[(3-chlorophenyl)thio]-3-methoxy-1-naphthalenyl] ester IUPAC Name: [4-acetyloxy-8-(3-chlorophenyl)sulfanyl-3-methoxynaphthalen-1-yl] acetate Traditional Name: acetic acid [4-acetoxy-8-[(3-chlorophenyl)thio]-3-methoxy-1-naphthyl] ester Formula: C21H17ClO5S MolecularWeight: 416.87468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C(C2=C1C(=CC=C2)SC3=CC(=CC=C3)Cl)OC(=O)C)OC

Isomeric SMILES

CC(=O)OC1=CC(=C(C2=C1C(=CC=C2)SC3=CC(=CC=C3)Cl)OC(=O)C)OC

InChI

InChI=1S/C21H17ClO5S/c1-12(23)26-17-11-18(25-3)21(27-13(2)24)16-8-5-9-19(20(16)17)28-15-7-4-6-14(22)10-15/h4-11H,1-3H3