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

Systemtic Name: (phenylmethyl) 2-[2-[4-(4-chlorophenyl)phenyl]sulfanylethoxy]naphthalene-1-carboxylate Openeye Name: benzyl 2-[2-[4-(4-chlorophenyl)phenyl]sulfanylethoxy]naphthalene-1-carboxylate CAS Name: 2-[2-[[4-(4-chlorophenyl)phenyl]thio]ethoxy]-1-naphthalenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[4-(4-chlorophenyl)phenyl]sulfanylethoxy]naphthalene-1-carboxylate Traditional Name: 2-[2-[[4-(4-chlorophenyl)phenyl]thio]ethoxy]naphthalene-1-carboxylic acid benzyl ester Formula: C32H25ClO3S MolecularWeight: 525.0571

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=C(C=CC3=CC=CC=C32)OCCSC4=CC=C(C=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=C(C=CC3=CC=CC=C32)OCCSC4=CC=C(C=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C32H25ClO3S/c33-27-15-10-24(11-16-27)25-12-17-28(18-13-25)37-21-20-35-30-19-14-26-8-4-5-9-29(26)31(30)32(34)36-22-23-6-2-1-3-7-23/h1-19H,20-22H2