1-[(5-chloranyl-2-methoxy-phenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(2,4,5-trimethoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[asaryl-(5-chloro-2-methoxy-phenyl)methyl]isonipecotic acid Formula: C23H28ClNO6 MolecularWeight: 449.92452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(C2=CC(=C(C=C2OC)OC)OC)N3CCC(CC3)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(C2=CC(=C(C=C2OC)OC)OC)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C23H28ClNO6/c1-28-18-6-5-15(24)11-16(18)22(25-9-7-14(8-10-25)23(26)27)17-12-20(30-3)21(31-4)13-19(17)29-2/h5-6,11-14,22H,7-10H2,1-4H3,(H,26,27)