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

Systemtic Name: 2-(4-hydroxyphenyl)-3-[4-[2-oxidanyl-3-(pentylamino)propoxy]phenoxy]-1-benzothiophen-6-ol Openeye Name: 3-[4-[2-hydroxy-3-(pentylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)benzothiophen-6-ol CAS Name: 3-[4-[2-hydroxy-3-(pentylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol IUPAC Name: 3-[4-[2-hydroxy-3-(pentylamino)propoxy]phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Traditional Name: 3-[4-[3-(amylamino)-2-hydroxy-propoxy]phenoxy]-2-(4-hydroxyphenyl)benzothiophen-6-ol Formula: C28H31NO5S MolecularWeight: 493.61444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC(COC1=CC=C(C=C1)OC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O)O

Isomeric SMILES

CCCCCNCC(COC1=CC=C(C=C1)OC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O)O

InChI

InChI=1S/C28H31NO5S/c1-2-3-4-15-29-17-22(32)18-33-23-10-12-24(13-11-23)34-27-25-14-9-21(31)16-26(25)35-28(27)19-5-7-20(30)8-6-19/h5-14,16,22,29-32H,2-4,15,17-18H2,1H3