methyl 2-[2-methyl-4-[(4-nitrophenyl)methyl]-5-propyl-pyrazol-3-yl]oxyethanoate

Systemtic Name: methyl 2-[2-methyl-4-[(4-nitrophenyl)methyl]-5-propyl-pyrazol-3-yl]oxyethanoate Openeye Name: methyl 2-[2-methyl-4-[(4-nitrophenyl)methyl]-5-propyl-pyrazol-3-yl]oxyacetate CAS Name: 2-[[2-methyl-4-[(4-nitrophenyl)methyl]-5-propyl-3-pyrazolyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-methyl-4-[(4-nitrophenyl)methyl]-5-propylpyrazol-3-yl]oxyacetate Traditional Name: 2-[2-methyl-4-(4-nitrobenzyl)-5-propyl-pyrazol-3-yl]oxyacetic acid methyl ester Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1CC2=CC=C(C=C2)[N+](=O)[O-])OCC(=O)OC)C

Isomeric SMILES

CCCC1=NN(C(=C1CC2=CC=C(C=C2)[N+](=O)[O-])OCC(=O)OC)C

InChI

InChI=1S/C17H21N3O5/c1-4-5-15-14(10-12-6-8-13(9-7-12)20(22)23)17(19(2)18-15)25-11-16(21)24-3/h6-9H,4-5,10-11H2,1-3H3