2-chloranyl-4-(2-methyl-5-phenyl-pyrrol-1-yl)benzoic acid

Systemtic Name: 2-chloranyl-4-(2-methyl-5-phenyl-pyrrol-1-yl)benzoic acid Openeye Name: 2-chloro-4-(2-methyl-5-phenyl-pyrrol-1-yl)benzoic acid CAS Name: 2-chloro-4-(2-methyl-5-phenyl-1-pyrrolyl)benzoic acid IUPAC Name: 2-chloro-4-(2-methyl-5-phenylpyrrol-1-yl)benzoic acid Traditional Name: 2-chloro-4-(2-methyl-5-phenyl-pyrrol-1-yl)benzoic acid Formula: C18H14ClNO2 MolecularWeight: 311.76226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=C(C=C2)C(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(N1C2=CC(=C(C=C2)C(=O)O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H14ClNO2/c1-12-7-10-17(13-5-3-2-4-6-13)20(12)14-8-9-15(18(21)22)16(19)11-14/h2-11H,1H3,(H,21,22)