(4-acetyloxy-3-methoxy-8-phenylsulfanyl-naphthalen-1-yl) ethanoate

Systemtic Name: (4-acetyloxy-3-methoxy-8-phenylsulfanyl-naphthalen-1-yl) ethanoate Openeye Name: (4-acetoxy-3-methoxy-8-phenylsulfanyl-1-naphthyl) acetate CAS Name: acetic acid [4-acetyloxy-3-methoxy-8-(phenylthio)-1-naphthalenyl] ester IUPAC Name: (4-acetyloxy-3-methoxy-8-phenylsulfanylnaphthalen-1-yl) acetate Traditional Name: acetic acid [4-acetoxy-3-methoxy-8-(phenylthio)-1-naphthyl] ester Formula: C21H18O5S MolecularWeight: 382.42962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18O5S/c1-13(22)25-17-12-18(24-3)21(26-14(2)23)16-10-7-11-19(20(16)17)27-15-8-5-4-6-9-15/h4-12H,1-3H3