3-[4-[3-(diethylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol

Systemtic Name: 3-[4-[3-(diethylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Openeye Name: 3-[4-[3-(diethylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)benzothiophen-6-ol CAS Name: 3-[4-[3-(diethylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol IUPAC Name: 3-[4-[3-(diethylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Traditional Name: 3-[4-[3-(diethylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)benzothiophen-6-ol Formula: C27H29NO4S MolecularWeight: 463.58846

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC1=CC=C(C=C1)OC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O

Isomeric SMILES

CCN(CC)CCCOC1=CC=C(C=C1)OC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C27H29NO4S/c1-3-28(4-2)16-5-17-31-22-11-13-23(14-12-22)32-26-24-15-10-21(30)18-25(24)33-27(26)19-6-8-20(29)9-7-19/h6-15,18,29-30H,3-5,16-17H2,1-2H3