ethyl 4-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-[2-(isobutylcarbamoylamino)-2-oxo-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-[2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethoxy]-1-(4-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-methylpropylcarbamoylamino)-2-oxoethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-[2-(isobutylcarbamoylamino)-2-keto-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C19H23N5O7 MolecularWeight: 433.41522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC(=O)NC(=O)NCC(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC(=O)NC(=O)NCC(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H23N5O7/c1-4-30-18(26)17-15(31-11-16(25)21-19(27)20-9-12(2)3)10-23(22-17)13-5-7-14(8-6-13)24(28)29/h5-8,10,12H,4,9,11H2,1-3H3,(H2,20,21,25,27)