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

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)-naphthalen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-thienyl)-(2-naphthyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-thiophenyl)-(2-naphthalenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-bromothiophen-2-yl)-naphthalen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-thienyl)-(2-naphthyl)methyl]pipecolinic acid Formula: C21H20BrNO2S MolecularWeight: 430.358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC3=CC=CC=C3C=C2)C4=CC=C(S4)Br

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC3=CC=CC=C3C=C2)C4=CC=C(S4)Br

InChI

InChI=1S/C21H20BrNO2S/c22-19-11-10-18(26-19)20(23-12-4-3-7-17(23)21(24)25)16-9-8-14-5-1-2-6-15(14)13-16/h1-2,5-6,8-11,13,17,20H,3-4,7,12H2,(H,24,25)