1-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,5-dibromo-2-methoxy-phenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,5-dibromo-2-methoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dibromo-2-methoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-(3,5-dibromo-2-methoxy-benzyl)pipecolinic acid Formula: C14H17Br2NO3 MolecularWeight: 407.09768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1CN2CCCCC2C(=O)O)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1CN2CCCCC2C(=O)O)Br)Br

InChI

InChI=1S/C14H17Br2NO3/c1-20-13-9(6-10(15)7-11(13)16)8-17-5-3-2-4-12(17)14(18)19/h6-7,12H,2-5,8H2,1H3,(H,18,19)