1-[(5-bromanyl-2-ethoxy-phenyl)-phenyl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-bromanyl-2-ethoxy-phenyl)-phenyl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-ethoxy-phenyl)-phenyl-methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-ethoxyphenyl)-phenylmethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-bromo-2-ethoxyphenyl)-phenylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-ethoxy-phenyl)-phenyl-methyl]pipecolinic acid Formula: C21H24BrNO3 MolecularWeight: 418.32416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2)N3CCCCC3C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2)N3CCCCC3C(=O)O

InChI

InChI=1S/C21H24BrNO3/c1-2-26-19-12-11-16(22)14-17(19)20(15-8-4-3-5-9-15)23-13-7-6-10-18(23)21(24)25/h3-5,8-9,11-12,14,18,20H,2,6-7,10,13H2,1H3,(H,24,25)