O1-methyl O4-[1-oxidanylidene-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[1-oxidanylidene-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl] benzene-1,4-dicarboxylate Openeye Name: O4-[2-[(2-isopropylpyrazol-3-yl)amino]-1-methyl-2-oxo-ethyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[1-oxo-1-[(2-propan-2-yl-3-pyrazolyl)amino]propan-2-yl] ester IUPAC Name: 1-O-methyl 4-O-[1-oxo-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-[(2-isopropylpyrazol-3-yl)amino]-2-keto-1-methyl-ethyl] ester O1-methyl ester Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)C(C)OC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)C(C)OC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H21N3O5/c1-11(2)21-15(9-10-19-21)20-16(22)12(3)26-18(24)14-7-5-13(6-8-14)17(23)25-4/h5-12H,1-4H3,(H,20,22)