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1-[(5-bromanylthiophen-2-yl)-(2,4-dichlorophenyl)methyl]piperidine-4-carboxylic acid

1-[(5-bromanylthiophen-2-yl)-(2,4-dichlorophenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name:1-[(5-bromanylthiophen-2-yl)-(2,4-dichlorophenyl)methyl]piperidine-4-carboxylic acid
Openeye Name:1-[(5-bromo-2-thienyl)-(2,4-dichlorophenyl)methyl]piperidine-4-carboxylic acid
CAS Name:1-[(5-bromo-2-thiophenyl)-(2,4-dichlorophenyl)methyl]-4-piperidinecarboxylic acid
IUPAC Name:1-[(5-bromothiophen-2-yl)-(2,4-dichlorophenyl)methyl]piperidine-4-carboxylic acid
Traditional Name:1-[(5-bromo-2-thienyl)-(2,4-dichlorophenyl)methyl]isonipecotic acid
Formula: C17H16BrCl2NO2S
MolecularWeight: 449.18944
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(S3)Br


Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(S3)Br


InChI

InChI=1S/C17H16BrCl2NO2S/c18-15-4-3-14(24-15)16(12-2-1-11(19)9-13(12)20)21-7-5-10(6-8-21)17(22)23/h1-4,9-10,16H,5-8H2,(H,22,23)


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