methyl 4-[[(3-methoxy-4-phenylmethoxy-phenyl)methyl-(3-phenylpropyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(3-methoxy-4-phenylmethoxy-phenyl)methyl-(3-phenylpropyl)amino]methyl]benzoate Openeye Name: methyl 4-[[(4-benzyloxy-3-methoxy-phenyl)methyl-(3-phenylpropyl)amino]methyl]benzoate CAS Name: 4-[[(3-methoxy-4-phenylmethoxyphenyl)methyl-(3-phenylpropyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-methoxy-4-phenylmethoxyphenyl)methyl-(3-phenylpropyl)amino]methyl]benzoate Traditional Name: 4-[[(4-benzoxy-3-methoxy-benzyl)-(3-phenylpropyl)amino]methyl]benzoic acid methyl ester Formula: C33H35NO4 MolecularWeight: 509.6353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CCCC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CN(CCCC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C33H35NO4/c1-36-32-22-29(17-20-31(32)38-25-28-12-7-4-8-13-28)24-34(21-9-14-26-10-5-3-6-11-26)23-27-15-18-30(19-16-27)33(35)37-2/h3-8,10-13,15-20,22H,9,14,21,23-25H2,1-2H3