3-[(3-chloranyl-4-methoxy-phenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylate

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylate Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3-[(3-chloro-4-methoxy-phenyl)methoxy]piperidine-1-carboxylate CAS Name: 3-[(3-chloro-4-methoxyphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]-1-piperidinecarboxylate IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylate Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3-(3-chloro-4-methoxy-benzyl)oxy-piperidine-1-carboxylate Formula: C30H33ClNO6- MolecularWeight: 539.03912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC2CN(CCC2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)C(=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)COC2CN(CCC2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)C(=O)[O-])Cl

InChI

InChI=1S/C30H34ClNO6/c1-35-28-13-8-23(18-27(28)31)21-38-29-19-32(30(33)34)15-14-26(29)24-9-11-25(12-10-24)37-17-5-16-36-20-22-6-3-2-4-7-22/h2-4,6-13,18,26,29H,5,14-17,19-21H2,1H3,(H,33,34)/p-1