bis[2-oxidanylidene-2-[(2-propan-2-ylpyrazol-3-yl)amino]ethyl] benzene-1,4-dicarboxylate

Systemtic Name: bis[2-oxidanylidene-2-[(2-propan-2-ylpyrazol-3-yl)amino]ethyl] benzene-1,4-dicarboxylate Openeye Name: bis[2-[(2-isopropylpyrazol-3-yl)amino]-2-oxo-ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis[2-oxo-2-[(2-propan-2-yl-3-pyrazolyl)amino]ethyl] ester IUPAC Name: bis[2-oxo-2-[(2-propan-2-ylpyrazol-3-yl)amino]ethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis[2-[(2-isopropylpyrazol-3-yl)amino]-2-keto-ethyl] ester Formula: C24H28N6O6 MolecularWeight: 496.51572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)COC(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=NN3C(C)C

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)COC(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=NN3C(C)C

InChI

InChI=1S/C24H28N6O6/c1-15(2)29-19(9-11-25-29)27-21(31)13-35-23(33)17-5-7-18(8-6-17)24(34)36-14-22(32)28-20-10-12-26-30(20)16(3)4/h5-12,15-16H,13-14H2,1-4H3,(H,27,31)(H,28,32)