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

Systemtic Name: 3-[1-(4-chloranyl-2-methyl-phenyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-chloro-2-methyl-phenyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(4-chloro-2-methylphenyl)-5-(4-methoxyphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(4-chloro-2-methylphenyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(4-chloro-2-methyl-phenyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propionic acid Formula: C21H20ClNO3 MolecularWeight: 369.8414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClNO3/c1-14-13-16(22)5-10-19(14)23-17(7-12-21(24)25)6-11-20(23)15-3-8-18(26-2)9-4-15/h3-6,8-11,13H,7,12H2,1-2H3,(H,24,25)