1-[[4-(1-benzothiophen-2-ylmethoxy)phenyl]methyl]pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[[4-(1-benzothiophen-2-ylmethoxy)phenyl]methyl]pyrrolidine-3-carboxylic acid Openeye Name: 1-[[4-(benzothiophen-2-ylmethoxy)phenyl]methyl]pyrrolidine-3-carboxylic acid CAS Name: 1-[[4-(1-benzothiophen-2-ylmethoxy)phenyl]methyl]-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[[4-(1-benzothiophen-2-ylmethoxy)phenyl]methyl]pyrrolidine-3-carboxylic acid Traditional Name: 1-[4-(benzothiophen-2-ylmethoxy)benzyl]pyrrolidine-3-carboxylic acid Formula: C21H21NO3S MolecularWeight: 367.46134

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C(=O)O)CC2=CC=C(C=C2)OCC3=CC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CC1C(=O)O)CC2=CC=C(C=C2)OCC3=CC4=CC=CC=C4S3

InChI

InChI=1S/C21H21NO3S/c23-21(24)17-9-10-22(13-17)12-15-5-7-18(8-6-15)25-14-19-11-16-3-1-2-4-20(16)26-19/h1-8,11,17H,9-10,12-14H2,(H,23,24)