[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-benzamidobenzoate

Systemtic Name: [2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-benzamidobenzoate Openeye Name: [2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-benzamidobenzoate CAS Name: 2-benzamidobenzoic acid [2-oxo-2-[(1,3,5-trimethyl-4-pyrazolyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-benzamidobenzoate Traditional Name: 2-benzamidobenzoic acid [2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] ester Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)COC(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)COC(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N4O4/c1-14-20(15(2)26(3)25-14)24-19(27)13-30-22(29)17-11-7-8-12-18(17)23-21(28)16-9-5-4-6-10-16/h4-12H,13H2,1-3H3,(H,23,28)(H,24,27)