3-[1-[(4-tert-butylphenyl)carbonylamino]-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-[(4-tert-butylphenyl)carbonylamino]-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-[(4-tert-butylbenzoyl)amino]-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-[[(4-tert-butylphenyl)-oxomethyl]amino]-5-(4-methoxyphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-[(4-tert-butylbenzoyl)amino]-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-[(4-tert-butylbenzoyl)amino]-5-(4-methoxyphenyl)pyrrol-2-yl]propionic acid Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NN2C(=CC=C2C3=CC=C(C=C3)OC)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NN2C(=CC=C2C3=CC=C(C=C3)OC)CCC(=O)O

InChI

InChI=1S/C25H28N2O4/c1-25(2,3)19-9-5-18(6-10-19)24(30)26-27-20(12-16-23(28)29)11-15-22(27)17-7-13-21(31-4)14-8-17/h5-11,13-15H,12,16H2,1-4H3,(H,26,30)(H,28,29)