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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(N2C3=C(C=CC(=C3)Cl)OC)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(N2C3=C(C=CC(=C3)Cl)OC)CCC(=O)O

InChI

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