2-[4-phenyl-1-[(4-phenylmethoxyphenyl)methyl]pyrrol-3-yl]propanoic acid

Systemtic Name: 2-[4-phenyl-1-[(4-phenylmethoxyphenyl)methyl]pyrrol-3-yl]propanoic acid Openeye Name: 2-[1-[(4-benzyloxyphenyl)methyl]-4-phenyl-pyrrol-3-yl]propanoic acid CAS Name: 2-[4-phenyl-1-[(4-phenylmethoxyphenyl)methyl]-3-pyrrolyl]propanoic acid IUPAC Name: 2-[4-phenyl-1-[(4-phenylmethoxyphenyl)methyl]pyrrol-3-yl]propanoic acid Traditional Name: 2-[1-(4-benzoxybenzyl)-4-phenyl-pyrrol-3-yl]propionic acid Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN(C=C1C2=CC=CC=C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C1=CN(C=C1C2=CC=CC=C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H25NO3/c1-20(27(29)30)25-17-28(18-26(25)23-10-6-3-7-11-23)16-21-12-14-24(15-13-21)31-19-22-8-4-2-5-9-22/h2-15,17-18,20H,16,19H2,1H3,(H,29,30)