1-methyl-5-(4-methylphenyl)carbonyl-pyrrole-2-carboxylate

Systemtic Name: 1-methyl-5-(4-methylphenyl)carbonyl-pyrrole-2-carboxylate Openeye Name: 1-methyl-5-(4-methylbenzoyl)pyrrole-2-carboxylate CAS Name: 1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolecarboxylate IUPAC Name: 1-methyl-5-(4-methylbenzoyl)pyrrole-2-carboxylate Traditional Name: 1-methyl-5-p-toluoyl-pyrrole-2-carboxylate Formula: C14H12NO3- MolecularWeight: 242.24998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO3/c1-9-3-5-10(6-4-9)13(16)11-7-8-12(14(17)18)15(11)2/h3-8H,1-2H3,(H,17,18)/p-1