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

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-(2,5-dimethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2,5-dimethoxyphenyl)methyl]pipecolinic acid Formula: C23H28ClNO5 MolecularWeight: 433.92512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=C(C=CC(=C2)OC)OC)N3CCCCC3C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=C(C=CC(=C2)OC)OC)N3CCCCC3C(=O)O

InChI

InChI=1S/C23H28ClNO5/c1-4-30-21-10-8-15(24)13-17(21)22(25-12-6-5-7-19(25)23(26)27)18-14-16(28-2)9-11-20(18)29-3/h8-11,13-14,19,22H,4-7,12H2,1-3H3,(H,26,27)