3-[(2,5-dimethylphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid

Systemtic Name: 3-[(2,5-dimethylphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3-[(2,5-dimethylphenyl)methoxy]piperidine-1-carboxylic acid CAS Name: 3-[(2,5-dimethylphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]-1-piperidinecarboxylic acid IUPAC Name: 3-[(2,5-dimethylphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3-(2,5-dimethylbenzyl)oxy-piperidine-1-carboxylic acid Formula: C31H37NO5 MolecularWeight: 503.62918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC2CN(CCC2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC2CN(CCC2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C31H37NO5/c1-23-9-10-24(2)27(19-23)22-37-30-20-32(31(33)34)16-15-29(30)26-11-13-28(14-12-26)36-18-6-17-35-21-25-7-4-3-5-8-25/h3-5,7-14,19,29-30H,6,15-18,20-22H2,1-2H3,(H,33,34)