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

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

Systemtic Name:1-[1-benzothiophen-2-yl-(3-bromophenyl)methyl]pyrrolidine-2-carboxylic acid
Openeye Name:1-[benzothiophen-2-yl-(3-bromophenyl)methyl]pyrrolidine-2-carboxylic acid
CAS Name:1-[1-benzothiophen-2-yl-(3-bromophenyl)methyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:1-[1-benzothiophen-2-yl-(3-bromophenyl)methyl]pyrrolidine-2-carboxylic acid
Traditional Name:1-[benzothiophen-2-yl-(3-bromophenyl)methyl]proline
Formula: C20H18BrNO2S
MolecularWeight: 416.33142
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C20H18BrNO2S/c21-15-7-3-6-14(11-15)19(22-10-4-8-16(22)20(23)24)18-12-13-5-1-2-9-17(13)25-18/h1-3,5-7,9,11-12,16,19H,4,8,10H2,(H,23,24)


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