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

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methoxy]-5-oxidanyl-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3-[(3-chloro-4-methoxy-phenyl)methoxy]-5-hydroxy-piperidine-1-carboxylic acid CAS Name: 3-[(3-chloro-4-methoxyphenyl)methoxy]-5-hydroxy-4-[4-(3-phenylmethoxypropoxy)phenyl]-1-piperidinecarboxylic acid IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methoxy]-5-hydroxy-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3-(3-chloro-4-methoxy-benzyl)oxy-5-hydroxy-piperidine-1-carboxylic acid Formula: C30H34ClNO7 MolecularWeight: 556.04646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H34ClNO7/c1-36-27-13-8-22(16-25(27)31)20-39-28-18-32(30(34)35)17-26(33)29(28)23-9-11-24(12-10-23)38-15-5-14-37-19-21-6-3-2-4-7-21/h2-4,6-13,16,26,28-29,33H,5,14-15,17-20H2,1H3,(H,34,35)