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

Systemtic Name: 3-[(4-methoxy-3-methyl-phenyl)methoxy]-5-oxidanyl-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3-hydroxy-5-[(4-methoxy-3-methyl-phenyl)methoxy]piperidine-1-carboxylic acid CAS Name: 3-hydroxy-5-[(4-methoxy-3-methylphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]-1-piperidinecarboxylic acid IUPAC Name: 3-hydroxy-5-[(4-methoxy-3-methylphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3-hydroxy-5-(4-methoxy-3-methyl-benzyl)oxy-piperidine-1-carboxylic acid Formula: C31H37NO7 MolecularWeight: 535.62798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)COC2CN(CC(C2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)O)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)COC2CN(CC(C2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)O)C(=O)O)OC

InChI

InChI=1S/C31H37NO7/c1-22-17-24(9-14-28(22)36-2)21-39-29-19-32(31(34)35)18-27(33)30(29)25-10-12-26(13-11-25)38-16-6-15-37-20-23-7-4-3-5-8-23/h3-5,7-14,17,27,29-30,33H,6,15-16,18-21H2,1-2H3,(H,34,35)