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

Systemtic Name: 3-[1-(5-chloranyl-2-methyl-phenyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(5-chloro-2-methyl-phenyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(5-chloro-2-methylphenyl)-5-(4-methoxyphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(5-chloro-2-methylphenyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(5-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=C(C=C1)Cl)N2C(=CC=C2C3=CC=C(C=C3)OC)CCC(=O)O

Isomeric SMILES

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

InChI

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