2,4,5-trimethyl-1-phenyl-pyrrole-3-carboxylate

Systemtic Name: 2,4,5-trimethyl-1-phenyl-pyrrole-3-carboxylate Openeye Name: 2,4,5-trimethyl-1-phenyl-pyrrole-3-carboxylate CAS Name: 2,4,5-trimethyl-1-phenyl-3-pyrrolecarboxylate IUPAC Name: 2,4,5-trimethyl-1-phenylpyrrole-3-carboxylate Traditional Name: 2,4,5-trimethyl-1-phenyl-pyrrole-3-carboxylate Formula: C14H14NO2- MolecularWeight: 228.26646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C(=O)[O-])C)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(N(C(=C1C(=O)[O-])C)C2=CC=CC=C2)C

InChI

InChI=1S/C14H15NO2/c1-9-10(2)15(11(3)13(9)14(16)17)12-7-5-4-6-8-12/h4-8H,1-3H3,(H,16,17)/p-1