methyl 5-methyl-4-[2-[(2-nitrophenyl)methyl]phenyl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-methyl-4-[2-[(2-nitrophenyl)methyl]phenyl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-methyl-4-[2-[(2-nitrophenyl)methyl]benzoyl]-1H-pyrrole-3-carboxylate CAS Name: 5-methyl-4-[[2-[(2-nitrophenyl)methyl]phenyl]-oxomethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-[2-[(2-nitrophenyl)methyl]benzoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-methyl-4-[2-(2-nitrobenzyl)benzoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1)C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CN1)C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O5/c1-13-19(17(12-22-13)21(25)28-2)20(24)16-9-5-3-7-14(16)11-15-8-4-6-10-18(15)23(26)27/h3-10,12,22H,11H2,1-2H3