ethyl 2,5-dimethyl-1-[(2-methylphenyl)methyl]-4-(4-nitrophenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[(2-methylphenyl)methyl]-4-(4-nitrophenyl)pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-(4-nitrophenyl)-1-(o-tolylmethyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[(2-methylphenyl)methyl]-4-(4-nitrophenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[(2-methylphenyl)methyl]-4-(4-nitrophenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(2-methylbenzyl)-4-(4-nitrophenyl)pyrrole-3-carboxylic acid ethyl ester Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)CC3=CC=CC=C3C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)CC3=CC=CC=C3C)C

InChI

InChI=1S/C23H24N2O4/c1-5-29-23(26)22-17(4)24(14-19-9-7-6-8-15(19)2)16(3)21(22)18-10-12-20(13-11-18)25(27)28/h6-13H,5,14H2,1-4H3