3-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-[(3-phenoxyphenyl)methyl]amino]propanoic acid

Systemtic Name: 3-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-[(3-phenoxyphenyl)methyl]amino]propanoic acid Openeye Name: 3-[(4-benzyloxy-3-methoxy-phenyl)methyl-[(3-phenoxyphenyl)methyl]amino]propanoic acid CAS Name: 3-[(3-methoxy-4-phenylmethoxyphenyl)methyl-[(3-phenoxyphenyl)methyl]amino]propanoic acid IUPAC Name: 3-[(3-methoxy-4-phenylmethoxyphenyl)methyl-[(3-phenoxyphenyl)methyl]amino]propanoic acid Traditional Name: 3-[(4-benzoxy-3-methoxy-benzyl)-(3-phenoxybenzyl)amino]propionic acid Formula: C31H31NO5 MolecularWeight: 497.58154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CCC(=O)O)CC2=CC(=CC=C2)OC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CN(CCC(=O)O)CC2=CC(=CC=C2)OC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C31H31NO5/c1-35-30-20-26(15-16-29(30)36-23-24-9-4-2-5-10-24)22-32(18-17-31(33)34)21-25-11-8-14-28(19-25)37-27-12-6-3-7-13-27/h2-16,19-20H,17-18,21-23H2,1H3,(H,33,34)