2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrole-3-carboxylate

Systemtic Name: 2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrole-3-carboxylate Openeye Name: 1-(4-isopropylphenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(4-propan-2-ylphenyl)-3-pyrrolecarboxylate IUPAC Name: 2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-p-cumenyl-pyrrole-3-carboxylate Formula: C16H18NO2- MolecularWeight: 256.31962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)C)C)C(=O)[O-]

InChI

InChI=1S/C16H19NO2/c1-10(2)13-5-7-14(8-6-13)17-11(3)9-15(12(17)4)16(18)19/h5-10H,1-4H3,(H,18,19)/p-1