2-[2-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]propanoylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]propanoylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]propanoylamino]-2-phenyl-acetic acid CAS Name: 2-[[2-[[[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-oxomethyl]amino]-1-oxopropyl]amino]-2-phenylacetic acid IUPAC Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethylpyrrole-3-carbonyl]amino]propanoylamino]-2-phenylacetic acid Traditional Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]propanoylamino]-2-phenyl-acetic acid Formula: C25H27N3O5 MolecularWeight: 449.49898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)NC(C)C(=O)NC(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)NC(C)C(=O)NC(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H27N3O5/c1-15-14-21(17(3)28(15)19-10-12-20(33-4)13-11-19)24(30)26-16(2)23(29)27-22(25(31)32)18-8-6-5-7-9-18/h5-14,16,22H,1-4H3,(H,26,30)(H,27,29)(H,31,32)