4-[3-(4,4-dimethyl-2,3-dihydrothiochromen-8-yl)prop-1-ynyl]phenol

Systemtic Name: 4-[3-(4,4-dimethyl-2,3-dihydrothiochromen-8-yl)prop-1-ynyl]phenol Openeye Name: 4-[3-(4,4-dimethylthiochroman-8-yl)prop-1-ynyl]phenol CAS Name: 4-[3-(4,4-dimethyl-2,3-dihydro-1-benzothiopyran-8-yl)prop-1-ynyl]phenol IUPAC Name: 4-[3-(4,4-dimethyl-2,3-dihydrothiochromen-8-yl)prop-1-ynyl]phenol Traditional Name: 4-[3-(4,4-dimethylthiochroman-8-yl)prop-1-ynyl]phenol Formula: C20H20OS MolecularWeight: 308.4372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCSC2=C1C=CC=C2CC#CC3=CC=C(C=C3)O)C

Isomeric SMILES

CC1(CCSC2=C1C=CC=C2CC#CC3=CC=C(C=C3)O)C

InChI

InChI=1S/C20H20OS/c1-20(2)13-14-22-19-16(7-4-8-18(19)20)6-3-5-15-9-11-17(21)12-10-15/h4,7-12,21H,6,13-14H2,1-2H3