2-[4-(2-hydroxyethyloxy)phenyl]-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-6-ol

Systemtic Name: 2-[4-(2-hydroxyethyloxy)phenyl]-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-6-ol Openeye Name: 2-[4-(2-hydroxyethoxy)phenyl]-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzothiophen-6-ol CAS Name: 2-[4-(2-hydroxyethoxy)phenyl]-3-[[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]methyl]-1-benzothiophen-6-ol IUPAC Name: 2-[4-(2-hydroxyethoxy)phenyl]-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-6-ol Traditional Name: 2-[4-(2-hydroxyethoxy)phenyl]-3-[3-methoxy-4-(pyrrolidinomethyl)benzyl]benzothiophen-6-ol Formula: C29H31NO4S MolecularWeight: 489.62574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)OCCO)CN5CCCC5

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)OCCO)CN5CCCC5

InChI

InChI=1S/C29H31NO4S/c1-33-27-17-20(4-5-22(27)19-30-12-2-3-13-30)16-26-25-11-8-23(32)18-28(25)35-29(26)21-6-9-24(10-7-21)34-15-14-31/h4-11,17-18,31-32H,2-3,12-16,19H2,1H3