8-methyl-3-phenyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-6-ol

Systemtic Name: 8-methyl-3-phenyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-6-ol Openeye Name: 8-methyl-3-phenyl-2-[4-[2-(1-piperidyl)ethoxy]phenyl]-2,3-dihydro-1,4-benzoxathiin-6-ol CAS Name: 8-methyl-3-phenyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2,3-dihydro-1,4-benzoxathiin-6-ol IUPAC Name: 8-methyl-3-phenyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-6-ol Traditional Name: 8-methyl-3-phenyl-2-[4-(2-piperidinoethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-6-ol Formula: C28H31NO3S MolecularWeight: 461.61564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1OC(C(S2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCCC5)O

Isomeric SMILES

CC1=CC(=CC2=C1OC(C(S2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCCC5)O

InChI

InChI=1S/C28H31NO3S/c1-20-18-23(30)19-25-26(20)32-27(28(33-25)22-8-4-2-5-9-22)21-10-12-24(13-11-21)31-17-16-29-14-6-3-7-15-29/h2,4-5,8-13,18-19,27-28,30H,3,6-7,14-17H2,1H3