4-[6-methoxy-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-2-yl]benzene-1,2-diol

Systemtic Name: 4-[6-methoxy-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-2-yl]benzene-1,2-diol Openeye Name: 4-[6-methoxy-3-[4-[2-(1-piperidyl)ethoxy]phenoxy]benzothiophen-2-yl]benzene-1,2-diol CAS Name: 4-[6-methoxy-3-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-1-benzothiophen-2-yl]benzene-1,2-diol IUPAC Name: 4-[6-methoxy-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-2-yl]benzene-1,2-diol Traditional Name: 4-[6-methoxy-3-[4-(2-piperidinoethoxy)phenoxy]benzothiophen-2-yl]pyrocatechol Formula: C28H29NO5S MolecularWeight: 491.59856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C3=CC(=C(C=C3)O)O)OC4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C3=CC(=C(C=C3)O)O)OC4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C28H29NO5S/c1-32-22-10-11-23-26(18-22)35-28(19-5-12-24(30)25(31)17-19)27(23)34-21-8-6-20(7-9-21)33-16-15-29-13-3-2-4-14-29/h5-12,17-18,30-31H,2-4,13-16H2,1H3