(4-nitrophenyl)methyl 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate Openeye Name: (4-nitrophenyl)methyl 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-phenyl-3-pyrrolecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2,5-dimethyl-1-phenylpyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid (4-nitrobenzyl) ester Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O4/c1-14-12-19(15(2)21(14)17-6-4-3-5-7-17)20(23)26-13-16-8-10-18(11-9-16)22(24)25/h3-12H,13H2,1-2H3