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1-[1-benzothiophen-3-yl-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

1-[1-benzothiophen-3-yl-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name:1-[1-benzothiophen-3-yl-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid
Openeye Name:1-[benzothiophen-3-yl-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid
CAS Name:1-[1-benzothiophen-3-yl-(3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:1-[1-benzothiophen-3-yl-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid
Traditional Name:1-[benzothiophen-3-yl-(3,4,5-trimethoxyphenyl)methyl]proline
Formula: C23H25NO5S
MolecularWeight: 427.5133
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C2=CSC3=CC=CC=C32)N4CCCC4C(=O)O


Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(C2=CSC3=CC=CC=C32)N4CCCC4C(=O)O


InChI

InChI=1S/C23H25NO5S/c1-27-18-11-14(12-19(28-2)22(18)29-3)21(24-10-6-8-17(24)23(25)26)16-13-30-20-9-5-4-7-15(16)20/h4-5,7,9,11-13,17,21H,6,8,10H2,1-3H3,(H,25,26)


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