[2-[2-[4-(2,2-dimethylpropanoylamino)phenyl]-2-oxidanylidene-ethanehydrazonoyl]phenyl] benzoate

Systemtic Name: [2-[2-[4-(2,2-dimethylpropanoylamino)phenyl]-2-oxidanylidene-ethanehydrazonoyl]phenyl] benzoate Openeye Name: [2-[2-[4-(2,2-dimethylpropanoylamino)phenyl]-2-oxo-ethanehydrazonoyl]phenyl] benzoate CAS Name: benzoic acid [2-[(1E)-2-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-1-hydrazinylidene-2-oxoethyl]phenyl] ester IUPAC Name: [2-[2-[4-(2,2-dimethylpropanoylamino)phenyl]-2-oxoethanehydrazonoyl]phenyl] benzoate Traditional Name: benzoic acid [2-[2-keto-2-[4-(pivaloylamino)phenyl]acetohydrazonoyl]phenyl] ester Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)C(=NN)C2=CC=CC=C2OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)/C(=N/N)/C2=CC=CC=C2OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H25N3O4/c1-26(2,3)25(32)28-19-15-13-17(14-16-19)23(30)22(29-27)20-11-7-8-12-21(20)33-24(31)18-9-5-4-6-10-18/h4-16H,27H2,1-3H3,(H,28,32)/b29-22+