2-chloranyl-4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid

Systemtic Name: 2-chloranyl-4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid Openeye Name: 2-chloro-4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid CAS Name: 2-chloro-4-(3-formyl-2,5-dimethyl-1-pyrrolyl)benzoic acid IUPAC Name: 2-chloro-4-(3-formyl-2,5-dimethylpyrrol-1-yl)benzoic acid Traditional Name: 2-chloro-4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid Formula: C14H12ClNO3 MolecularWeight: 277.70298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12ClNO3/c1-8-5-10(7-17)9(2)16(8)11-3-4-12(14(18)19)13(15)6-11/h3-7H,1-2H3,(H,18,19)