1-[(4-bromophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(4-bromophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-bromophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-bromophenyl)-(4-ethylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)-(4-ethylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-bromophenyl)-(4-ethylphenyl)methyl]pipecolinic acid Formula: C21H24BrNO2 MolecularWeight: 402.32476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)N3CCCCC3C(=O)O

InChI

InChI=1S/C21H24BrNO2/c1-2-15-6-8-16(9-7-15)20(17-10-12-18(22)13-11-17)23-14-4-3-5-19(23)21(24)25/h6-13,19-20H,2-5,14H2,1H3,(H,24,25)