1-[1-benzothiophen-2-yl(pyridin-3-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-benzothiophen-2-yl(pyridin-3-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[benzothiophen-2-yl(3-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-benzothiophen-2-yl(3-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-benzothiophen-2-yl(pyridin-3-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[benzothiophen-2-yl(3-pyridyl)methyl]proline Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CN=CC=C2)C3=CC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CN=CC=C2)C3=CC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C19H18N2O2S/c22-19(23)15-7-4-10-21(15)18(14-6-3-9-20-12-14)17-11-13-5-1-2-8-16(13)24-17/h1-3,5-6,8-9,11-12,15,18H,4,7,10H2,(H,22,23)