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

Systemtic Name: 1-[[2,3-bis(chloranyl)phenyl]-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,3-dichlorophenyl)-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,3-dichlorophenyl)-(2,5-dimethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,3-dichlorophenyl)-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,3-dichlorophenyl)-(2,5-dimethoxyphenyl)methyl]pipecolinic acid Formula: C21H23Cl2NO4 MolecularWeight: 424.31762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(C2=C(C(=CC=C2)Cl)Cl)N3CCCCC3C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(C2=C(C(=CC=C2)Cl)Cl)N3CCCCC3C(=O)O

InChI

InChI=1S/C21H23Cl2NO4/c1-27-13-9-10-18(28-2)15(12-13)20(14-6-5-7-16(22)19(14)23)24-11-4-3-8-17(24)21(25)26/h5-7,9-10,12,17,20H,3-4,8,11H2,1-2H3,(H,25,26)