5-methyl-2-pyrrol-1-yl-benzoate

Systemtic Name: 5-methyl-2-pyrrol-1-yl-benzoate Openeye Name: 5-methyl-2-pyrrol-1-yl-benzoate CAS Name: 5-methyl-2-(1-pyrrolyl)benzoate IUPAC Name: 5-methyl-2-pyrrol-1-ylbenzoate Traditional Name: 5-methyl-2-pyrrol-1-yl-benzoate Formula: C12H10NO2- MolecularWeight: 200.2133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC=C2)C(=O)[O-]

InChI

InChI=1S/C12H11NO2/c1-9-4-5-11(10(8-9)12(14)15)13-6-2-3-7-13/h2-8H,1H3,(H,14,15)/p-1