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

Systemtic Name: 3-[2-(4-aminocarbonyl-2-methyl-phenyl)-1-(4-methoxyphenyl)pyrrol-3-yl]propanoic acid Openeye Name: 3-[2-(4-carbamoyl-2-methyl-phenyl)-1-(4-methoxyphenyl)pyrrol-3-yl]propanoic acid CAS Name: 3-[2-(4-carbamoyl-2-methylphenyl)-1-(4-methoxyphenyl)-3-pyrrolyl]propanoic acid IUPAC Name: 3-[2-(4-carbamoyl-2-methylphenyl)-1-(4-methoxyphenyl)pyrrol-3-yl]propanoic acid Traditional Name: 3-[2-(4-carbamoyl-2-methyl-phenyl)-1-(4-methoxyphenyl)pyrrol-3-yl]propionic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N)C2=C(C=CN2C3=CC=C(C=C3)OC)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N)C2=C(C=CN2C3=CC=C(C=C3)OC)CCC(=O)O

InChI

InChI=1S/C22H22N2O4/c1-14-13-16(22(23)27)3-9-19(14)21-15(4-10-20(25)26)11-12-24(21)17-5-7-18(28-2)8-6-17/h3,5-9,11-13H,4,10H2,1-2H3,(H2,23,27)(H,25,26)