(4-methylphenyl) 5,5-dimethyl-8-phenylsulfanyl-6H-naphthalene-2-carboxylate

Systemtic Name: (4-methylphenyl) 5,5-dimethyl-8-phenylsulfanyl-6H-naphthalene-2-carboxylate Openeye Name: p-tolyl 5,5-dimethyl-8-phenylsulfanyl-6H-naphthalene-2-carboxylate CAS Name: 5,5-dimethyl-8-(phenylthio)-6H-naphthalene-2-carboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 5,5-dimethyl-8-phenylsulfanyl-6H-naphthalene-2-carboxylate Traditional Name: 5,5-dimethyl-8-(phenylthio)-6H-naphthalene-2-carboxylic acid p-tolyl ester Formula: C26H24O2S MolecularWeight: 400.53256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)C(CC=C3SC4=CC=CC=C4)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)C(CC=C3SC4=CC=CC=C4)(C)C

InChI

InChI=1S/C26H24O2S/c1-18-9-12-20(13-10-18)28-25(27)19-11-14-23-22(17-19)24(15-16-26(23,2)3)29-21-7-5-4-6-8-21/h4-15,17H,16H2,1-3H3