1-[(3-bromophenyl)-(3-methylpyridin-4-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-(3-methylpyridin-4-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(3-methyl-4-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-bromophenyl)-(3-methyl-4-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-(3-methylpyridin-4-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(3-methyl-4-pyridyl)methyl]pipecolinic acid Formula: C19H21BrN2O2 MolecularWeight: 389.28624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=CC(=CC=C2)Br)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=CC(=CC=C2)Br)N3CCCCC3C(=O)O

InChI

InChI=1S/C19H21BrN2O2/c1-13-12-21-9-8-16(13)18(14-5-4-6-15(20)11-14)22-10-3-2-7-17(22)19(23)24/h4-6,8-9,11-12,17-18H,2-3,7,10H2,1H3,(H,23,24)