1-[(3-bromophenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(m-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-bromophenyl)-(3-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(m-tolyl)methyl]pipecolinic acid Formula: C20H22BrNO2 MolecularWeight: 388.29818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrNO2/c1-14-6-4-7-15(12-14)19(16-8-5-9-17(21)13-16)22-11-3-2-10-18(22)20(23)24/h4-9,12-13,18-19H,2-3,10-11H2,1H3,(H,23,24)