3-[(3,5-dimethoxyphenyl)methoxy]-5-oxidanyl-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid

Systemtic Name: 3-[(3,5-dimethoxyphenyl)methoxy]-5-oxidanyl-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3-[(3,5-dimethoxyphenyl)methoxy]-5-hydroxy-piperidine-1-carboxylic acid CAS Name: 3-[(3,5-dimethoxyphenyl)methoxy]-5-hydroxy-4-[4-(3-phenylmethoxypropoxy)phenyl]-1-piperidinecarboxylic acid IUPAC Name: 3-[(3,5-dimethoxyphenyl)methoxy]-5-hydroxy-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3-(3,5-dimethoxybenzyl)oxy-5-hydroxy-piperidine-1-carboxylic acid Formula: C31H37NO8 MolecularWeight: 551.62738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)COC2CN(CC(C2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)O)C(=O)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)COC2CN(CC(C2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)O)C(=O)O)OC

InChI

InChI=1S/C31H37NO8/c1-36-26-15-23(16-27(17-26)37-2)21-40-29-19-32(31(34)35)18-28(33)30(29)24-9-11-25(12-10-24)39-14-6-13-38-20-22-7-4-3-5-8-22/h3-5,7-12,15-17,28-30,33H,6,13-14,18-21H2,1-2H3,(H,34,35)