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

Systemtic Name: ethyl 1,5-dimethyl-3-[(2-nitrophenyl)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 1,5-dimethyl-3-[(2-nitrophenyl)methyl]pyrazole-4-carboxylate CAS Name: 1,5-dimethyl-3-[(2-nitrophenyl)methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,5-dimethyl-3-[(2-nitrophenyl)methyl]pyrazole-4-carboxylate Traditional Name: 1,5-dimethyl-3-(2-nitrobenzyl)pyrazole-4-carboxylic acid ethyl ester Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1CC2=CC=CC=C2[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1CC2=CC=CC=C2[N+](=O)[O-])C)C

InChI

InChI=1S/C15H17N3O4/c1-4-22-15(19)14-10(2)17(3)16-12(14)9-11-7-5-6-8-13(11)18(20)21/h5-8H,4,9H2,1-3H3