(4-nitrophenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid (4-nitrobenzyl) ester Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H14N2O5/c1-10(18)12-7-14(16(2)8-12)15(19)22-9-11-3-5-13(6-4-11)17(20)21/h3-8H,9H2,1-2H3