6-[(2,6-dimethylphenyl)methoxy]cyclohexa-1,5-diene-1-carbothioic S-acid

Systemtic Name: 6-[(2,6-dimethylphenyl)methoxy]cyclohexa-1,5-diene-1-carbothioic S-acid Openeye Name: 6-[(2,6-dimethylphenyl)methoxy]cyclohexa-1,5-diene-1-carbothioic S-acid CAS Name: 6-[(2,6-dimethylphenyl)methoxy]-1-cyclohexa-1,5-dienecarbothioic S-acid IUPAC Name: 6-[(2,6-dimethylphenyl)methoxy]cyclohexa-1,5-diene-1-carbothioic S-acid Traditional Name: 6-(2,6-dimethylbenzyl)oxycyclohexa-1,5-diene-1-carbothioic S-acid Formula: C16H18O2S MolecularWeight: 274.37792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)COC2=CCCC=C2C(=O)S

Isomeric SMILES

CC1=C(C(=CC=C1)C)COC2=CCCC=C2C(=O)S

InChI

InChI=1S/C16H18O2S/c1-11-6-5-7-12(2)14(11)10-18-15-9-4-3-8-13(15)16(17)19/h5-9H,3-4,10H2,1-2H3,(H,17,19)