1-(3-nitrophenyl)ethyl 1-methylpyrazole-4-carboxylate

Systemtic Name: 1-(3-nitrophenyl)ethyl 1-methylpyrazole-4-carboxylate Openeye Name: 1-(3-nitrophenyl)ethyl 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid 1-(3-nitrophenyl)ethyl ester IUPAC Name: 1-(3-nitrophenyl)ethyl 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid 1-(3-nitrophenyl)ethyl ester Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O4/c1-9(10-4-3-5-12(6-10)16(18)19)20-13(17)11-7-14-15(2)8-11/h3-9H,1-2H3