methyl 4-[[1-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[1-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[1-(2-ethoxy-2-oxo-ethyl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoate CAS Name: 4-[[[1-(2-ethoxy-2-oxoethyl)-5-methyl-3-pyrazolyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(2-ethoxy-2-oxoethyl)-5-methylpyrazol-3-yl]carbamoyl]benzoate Traditional Name: 4-[[1-(2-ethoxy-2-keto-ethyl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoic acid methyl ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=CC(=N1)NC(=O)C2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CCOC(=O)CN1C(=CC(=N1)NC(=O)C2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C17H19N3O5/c1-4-25-15(21)10-20-11(2)9-14(19-20)18-16(22)12-5-7-13(8-6-12)17(23)24-3/h5-9H,4,10H2,1-3H3,(H,18,19,22)