methyl 4-[(E)-2-(5,5-dimethyl-8-propan-2-ylsulfanyl-6H-naphthalen-2-yl)ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-(5,5-dimethyl-8-propan-2-ylsulfanyl-6H-naphthalen-2-yl)ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-(8-isopropylsulfanyl-5,5-dimethyl-6H-naphthalen-2-yl)vinyl]benzoate CAS Name: 4-[(E)-2-[5,5-dimethyl-8-(propan-2-ylthio)-6H-naphthalen-2-yl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-(5,5-dimethyl-8-propan-2-ylsulfanyl-6H-naphthalen-2-yl)ethenyl]benzoate Traditional Name: 4-[(E)-2-[8-(isopropylthio)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid methyl ester Formula: C25H28O2S MolecularWeight: 392.55362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CCC(C2=C1C=C(C=C2)C=CC3=CC=C(C=C3)C(=O)OC)(C)C

Isomeric SMILES

CC(C)SC1=CCC(C2=C1C=C(C=C2)/C=C/C3=CC=C(C=C3)C(=O)OC)(C)C

InChI

InChI=1S/C25H28O2S/c1-17(2)28-23-14-15-25(3,4)22-13-10-19(16-21(22)23)7-6-18-8-11-20(12-9-18)24(26)27-5/h6-14,16-17H,15H2,1-5H3/b7-6+