1-[(5-bromanylthiophen-2-yl)-(5-ethylthiophen-2-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)-(5-ethylthiophen-2-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-thienyl)-(5-ethyl-2-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-thiophenyl)-(5-ethyl-2-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-bromothiophen-2-yl)-(5-ethylthiophen-2-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-thienyl)-(5-ethyl-2-thienyl)methyl]pipecolinic acid Formula: C17H20BrNO2S2 MolecularWeight: 414.3802

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=C(S2)Br)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=C(S2)Br)N3CCCCC3C(=O)O

InChI

InChI=1S/C17H20BrNO2S2/c1-2-11-6-7-13(22-11)16(14-8-9-15(18)23-14)19-10-4-3-5-12(19)17(20)21/h6-9,12,16H,2-5,10H2,1H3,(H,20,21)