4-dodecoxy-2,6-bis(4-methoxyphenyl)thiane

Systemtic Name: 4-dodecoxy-2,6-bis(4-methoxyphenyl)thiane Openeye Name: 4-dodecoxy-2,6-bis(4-methoxyphenyl)tetrahydrothiopyran CAS Name: 4-dodecoxy-2,6-bis(4-methoxyphenyl)thiane IUPAC Name: 4-dodecoxy-2,6-bis(4-methoxyphenyl)thiane Traditional Name: 4-lauryloxy-2,6-bis(4-methoxyphenyl)tetrahydrothiopyran Formula: C31H46O3S MolecularWeight: 498.76014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1CC(SC(C1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCCCCCCCOC1CC(SC(C1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C31H46O3S/c1-4-5-6-7-8-9-10-11-12-13-22-34-29-23-30(25-14-18-27(32-2)19-15-25)35-31(24-29)26-16-20-28(33-3)21-17-26/h14-21,29-31H,4-13,22-24H2,1-3H3