(4-methylphenyl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: (4-methylphenyl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: p-tolylmethyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid (4-methylbenzyl) ester Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=CC(=CN2C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=CC(=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O4/c1-10-3-5-11(6-4-10)9-20-14(17)13-7-12(16(18)19)8-15(13)2/h3-8H,9H2,1-2H3