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

Systemtic Name: 4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenol Openeye Name: 4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzothiophen-2-yl]phenol CAS Name: 4-[3-[[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenol IUPAC Name: 4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenol Traditional Name: 4-[3-[3-methoxy-4-(pyrrolidinomethyl)benzyl]benzothiophen-2-yl]phenol Formula: C27H27NO2S MolecularWeight: 429.57378

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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)CN5CCCC5

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)O)CN5CCCC5

InChI

InChI=1S/C27H27NO2S/c1-30-25-17-19(8-9-21(25)18-28-14-4-5-15-28)16-24-23-6-2-3-7-26(23)31-27(24)20-10-12-22(29)13-11-20/h2-3,6-13,17,29H,4-5,14-16,18H2,1H3