3-(4-methoxyphenyl)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-7-ol

Systemtic Name: 3-(4-methoxyphenyl)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-7-ol Openeye Name: 3-(4-methoxyphenyl)-2-[4-[2-(1-piperidyl)ethoxy]phenyl]-2,3-dihydro-1,4-benzoxathiin-7-ol CAS Name: 3-(4-methoxyphenyl)-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2,3-dihydro-1,4-benzoxathiin-7-ol IUPAC Name: 3-(4-methoxyphenyl)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-7-ol Traditional Name: 3-(4-methoxyphenyl)-2-[4-(2-piperidinoethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-7-ol Formula: C28H31NO4S MolecularWeight: 477.61504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(OC3=C(S2)C=CC(=C3)O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2C(OC3=C(S2)C=CC(=C3)O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C28H31NO4S/c1-31-23-10-7-21(8-11-23)28-27(33-25-19-22(30)9-14-26(25)34-28)20-5-12-24(13-6-20)32-18-17-29-15-3-2-4-16-29/h5-14,19,27-28,30H,2-4,15-18H2,1H3