5-chloranyl-2-methoxy-4-pyrrol-1-yl-benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-pyrrol-1-yl-benzoic acid Openeye Name: 5-chloro-2-methoxy-4-pyrrol-1-yl-benzoic acid CAS Name: 5-chloro-2-methoxy-4-(1-pyrrolyl)benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-pyrrol-1-ylbenzoic acid Traditional Name: 5-chloro-2-methoxy-4-pyrrol-1-yl-benzoic acid Formula: C12H10ClNO3 MolecularWeight: 251.6657

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)O)Cl)N2C=CC=C2

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)O)Cl)N2C=CC=C2

InChI

InChI=1S/C12H10ClNO3/c1-17-11-7-10(14-4-2-3-5-14)9(13)6-8(11)12(15)16/h2-7H,1H3,(H,15,16)