4-[(E)-2-(8-ethylsulfanyl-5,5-dimethyl-6H-naphthalen-2-yl)ethenyl]benzoic acid

Systemtic Name: 4-[(E)-2-(8-ethylsulfanyl-5,5-dimethyl-6H-naphthalen-2-yl)ethenyl]benzoic acid Openeye Name: 4-[(E)-2-(8-ethylsulfanyl-5,5-dimethyl-6H-naphthalen-2-yl)vinyl]benzoic acid CAS Name: 4-[(E)-2-[8-(ethylthio)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid IUPAC Name: 4-[(E)-2-(8-ethylsulfanyl-5,5-dimethyl-6H-naphthalen-2-yl)ethenyl]benzoic acid Traditional Name: 4-[(E)-2-[8-(ethylthio)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid Formula: C23H24O2S MolecularWeight: 364.50046

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CCC(C2=C1C=C(C=C2)C=CC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CCSC1=CCC(C2=C1C=C(C=C2)/C=C/C3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C23H24O2S/c1-4-26-21-13-14-23(2,3)20-12-9-17(15-19(20)21)6-5-16-7-10-18(11-8-16)22(24)25/h5-13,15H,4,14H2,1-3H3,(H,24,25)/b6-5+