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

Systemtic Name: 2,5-dimethyl-1-(4-phenylmethoxyphenyl)pyrrole-3-carboxylate Openeye Name: 1-(4-benzyloxyphenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(4-phenylmethoxyphenyl)-3-pyrrolecarboxylate IUPAC Name: 2,5-dimethyl-1-(4-phenylmethoxyphenyl)pyrrole-3-carboxylate Traditional Name: 1-(4-benzoxyphenyl)-2,5-dimethyl-pyrrole-3-carboxylate Formula: C20H18NO3- MolecularWeight: 320.36182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C)C(=O)[O-]

InChI

InChI=1S/C20H19NO3/c1-14-12-19(20(22)23)15(2)21(14)17-8-10-18(11-9-17)24-13-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,22,23)/p-1