2-[[4-[(4-butylphenyl)methoxy]phenyl]carbonylamino]-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-[[4-[(4-butylphenyl)methoxy]phenyl]carbonylamino]-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-2-[[4-[(4-butylphenyl)methoxy]benzoyl]amino]propanoic acid CAS Name: 2-[[[4-[(4-butylphenyl)methoxy]phenyl]-oxomethyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-[[4-[(4-butylphenyl)methoxy]benzoyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxyphenyl)-2-[[4-(4-butylbenzyl)oxybenzoyl]amino]propionic acid Formula: C34H35NO5 MolecularWeight: 537.6454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C34H35NO5/c1-2-3-7-25-10-12-28(13-11-25)24-40-31-20-16-29(17-21-31)33(36)35-32(34(37)38)22-26-14-18-30(19-15-26)39-23-27-8-5-4-6-9-27/h4-6,8-21,32H,2-3,7,22-24H2,1H3,(H,35,36)(H,37,38)