(phenylmethyl) 2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylethoxy]naphthalene-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylethoxy]naphthalene-1-carboxylate Openeye Name: benzyl 2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylethoxy]naphthalene-1-carboxylate CAS Name: 2-[2-[[4-(4-methoxyphenyl)phenyl]thio]ethoxy]-1-naphthalenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylethoxy]naphthalene-1-carboxylate Traditional Name: 2-[2-[[4-(4-methoxyphenyl)phenyl]thio]ethoxy]naphthalene-1-carboxylic acid benzyl ester Formula: C33H28O4S MolecularWeight: 520.63802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)SCCOC3=C(C4=CC=CC=C4C=C3)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)SCCOC3=C(C4=CC=CC=C4C=C3)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C33H28O4S/c1-35-28-16-11-25(12-17-28)26-13-18-29(19-14-26)38-22-21-36-31-20-15-27-9-5-6-10-30(27)32(31)33(34)37-23-24-7-3-2-4-8-24/h2-20H,21-23H2,1H3