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

Systemtic Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]propanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]propanoylamino]-3-methyl-butanoic acid CAS Name: 2-[[2-[[[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-oxomethyl]amino]-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethylpyrrole-3-carbonyl]amino]propanoylamino]-3-methylbutanoic acid Traditional Name: 2-[2-[[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]propanoylamino]-3-methyl-butyric acid Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O5/c1-12(2)19(22(28)29)24-20(26)14(4)23-21(27)18-11-13(3)25(15(18)5)16-7-9-17(30-6)10-8-16/h7-12,14,19H,1-6H3,(H,23,27)(H,24,26)(H,28,29)