3-[1-(4-aminocarbonyl-2-methyl-phenyl)-5-(4-hydroxyphenyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(4-aminocarbonyl-2-methyl-phenyl)-5-(4-hydroxyphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-(4-hydroxyphenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(4-carbamoyl-2-methylphenyl)-5-(4-hydroxyphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(4-carbamoyl-2-methylphenyl)-5-(4-hydroxyphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-(4-hydroxyphenyl)pyrrol-2-yl]propionic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N)N2C(=CC=C2C3=CC=C(C=C3)O)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N)N2C(=CC=C2C3=CC=C(C=C3)O)CCC(=O)O

InChI

InChI=1S/C21H20N2O4/c1-13-12-15(21(22)27)4-9-18(13)23-16(6-11-20(25)26)5-10-19(23)14-2-7-17(24)8-3-14/h2-5,7-10,12,24H,6,11H2,1H3,(H2,22,27)(H,25,26)