[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate CAS Name: 5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate Traditional Name: 5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=C(NN=C1)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=C(NN=C1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H22N4O5/c1-3-4-9-19-18(25)21-15(23)11-27-17(24)14-10-20-22-16(14)12-5-7-13(26-2)8-6-12/h5-8,10H,3-4,9,11H2,1-2H3,(H,20,22)(H2,19,21,23,25)