2-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)heptanal

Systemtic Name: 2-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)heptanal Openeye Name: 2-(4,4-dimethylthiochroman-6-yl)heptanal CAS Name: 2-(4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-yl)heptanal IUPAC Name: 2-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)heptanal Traditional Name: 2-(4,4-dimethylthiochroman-6-yl)enanthaldehyde Formula: C18H26OS MolecularWeight: 290.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=O)C1=CC2=C(C=C1)SCCC2(C)C

Isomeric SMILES

CCCCCC(C=O)C1=CC2=C(C=C1)SCCC2(C)C

InChI

InChI=1S/C18H26OS/c1-4-5-6-7-15(13-19)14-8-9-17-16(12-14)18(2,3)10-11-20-17/h8-9,12-13,15H,4-7,10-11H2,1-3H3