1-(2,6-diethylphenyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: 1-(2,6-diethylphenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: 1-(2,6-diethylphenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(2,6-diethylphenyl)-2,5-dimethyl-3-pyrrolecarboxylate IUPAC Name: 1-(2,6-diethylphenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(2,6-diethylphenyl)-2,5-dimethyl-pyrrole-3-carboxylate Formula: C17H20NO2- MolecularWeight: 270.3462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2C(=CC(=C2C)C(=O)[O-])C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C(=CC(=C2C)C(=O)[O-])C

InChI

InChI=1S/C17H21NO2/c1-5-13-8-7-9-14(6-2)16(13)18-11(3)10-15(12(18)4)17(19)20/h7-10H,5-6H2,1-4H3,(H,19,20)/p-1