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

Systemtic Name: 3-[2-(4-aminocarbonyl-2-methyl-phenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]hexanoic acid Openeye Name: 3-[2-(4-carbamoyl-2-methyl-phenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]hexanoic acid CAS Name: 3-[2-(4-carbamoyl-2-methylphenyl)-3-(4-methoxyphenyl)-1-pyrrolyl]hexanoic acid IUPAC Name: 3-[2-(4-carbamoyl-2-methylphenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]hexanoic acid Traditional Name: 3-[2-(4-carbamoyl-2-methyl-phenyl)-3-(4-methoxyphenyl)pyrrol-1-yl]hexanoic acid Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)O)N1C=CC(=C1C2=C(C=C(C=C2)C(=O)N)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC(CC(=O)O)N1C=CC(=C1C2=C(C=C(C=C2)C(=O)N)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H28N2O4/c1-4-5-19(15-23(28)29)27-13-12-22(17-6-9-20(31-3)10-7-17)24(27)21-11-8-18(25(26)30)14-16(21)2/h6-14,19H,4-5,15H2,1-3H3,(H2,26,30)(H,28,29)