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1-[1-benzothiophen-3-yl-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid

1-[1-benzothiophen-3-yl-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name:1-[1-benzothiophen-3-yl-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid
Openeye Name:1-[benzothiophen-3-yl-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid
CAS Name:1-[1-benzothiophen-3-yl-(2,5-dimethoxyphenyl)methyl]-2-piperidinecarboxylic acid
IUPAC Name:1-[1-benzothiophen-3-yl-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid
Traditional Name:1-[benzothiophen-3-yl-(2,5-dimethoxyphenyl)methyl]pipecolinic acid
Formula: C23H25NO4S
MolecularWeight: 411.5139
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(C2=CSC3=CC=CC=C32)N4CCCCC4C(=O)O


Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(C2=CSC3=CC=CC=C32)N4CCCCC4C(=O)O


InChI

InChI=1S/C23H25NO4S/c1-27-15-10-11-20(28-2)17(13-15)22(24-12-6-5-8-19(24)23(25)26)18-14-29-21-9-4-3-7-16(18)21/h3-4,7,9-11,13-14,19,22H,5-6,8,12H2,1-2H3,(H,25,26)


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