[2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-amino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate

Systemtic Name: [2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-amino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate Openeye Name: [2-[2-(2-furylmethylcarbamoyl)-N-methyl-anilino]-2-oxo-ethyl] 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid [2-[2-[(2-furanylmethylamino)-oxomethyl]-N-methylanilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(furan-2-ylmethylcarbamoyl)-N-methylanilino]-2-oxoethyl] 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid [2-[2-(2-furfurylcarbamoyl)-N-methyl-anilino]-2-keto-ethyl] ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)OCC(=O)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CO3

Isomeric SMILES

CN1C=C(C=N1)C(=O)OCC(=O)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H20N4O5/c1-23-12-14(10-22-23)20(27)29-13-18(25)24(2)17-8-4-3-7-16(17)19(26)21-11-15-6-5-9-28-15/h3-10,12H,11,13H2,1-2H3,(H,21,26)