ethyl 4-[(3-butyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[(3-butyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-[(3-butyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-[(3-butyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(4-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-butyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-[(3-butyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C19H21N5O6 MolecularWeight: 415.39994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)COC2=CN(N=C2C(=O)OCC)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NOC(=N1)COC2=CN(N=C2C(=O)OCC)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O6/c1-3-5-6-16-20-17(30-22-16)12-29-15-11-23(21-18(15)19(25)28-4-2)13-7-9-14(10-8-13)24(26)27/h7-11H,3-6,12H2,1-2H3