4-[3-[[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenol

Systemtic Name: 4-[3-[[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenol Openeye Name: 4-[3-[[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]benzothiophen-2-yl]phenol CAS Name: 4-[3-[[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenol IUPAC Name: 4-[3-[[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenol Traditional Name: 4-[3-[3-methoxy-4-(2-pyrrolidinoethoxy)benzyl]benzothiophen-2-yl]phenol Formula: C28H29NO3S MolecularWeight: 459.59976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)O)OCCN5CCCC5

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)O)OCCN5CCCC5

InChI

InChI=1S/C28H29NO3S/c1-31-26-19-20(8-13-25(26)32-17-16-29-14-4-5-15-29)18-24-23-6-2-3-7-27(23)33-28(24)21-9-11-22(30)12-10-21/h2-3,6-13,19,30H,4-5,14-18H2,1H3