4-nitro-2-[(E)-[[4-(phenylcarbamoylamino)phenyl]carbonylhydrazinylidene]methyl]phenolate

Systemtic Name: 4-nitro-2-[(E)-[[4-(phenylcarbamoylamino)phenyl]carbonylhydrazinylidene]methyl]phenolate Openeye Name: 4-nitro-2-[(E)-[[4-(phenylcarbamoylamino)benzoyl]hydrazono]methyl]phenolate CAS Name: 2-[(E)-[[[4-[[anilino(oxo)methyl]amino]phenyl]-oxomethyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 4-nitro-2-[(E)-[[4-(phenylcarbamoylamino)benzoyl]hydrazinylidene]methyl]phenolate Traditional Name: 4-nitro-2-[(E)-[[4-(phenylcarbamoylamino)benzoyl]hydrazono]methyl]phenolate Formula: C21H16N5O5- MolecularWeight: 418.38224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C(=O)NN=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C(=O)N/N=C/C3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C21H17N5O5/c27-19-11-10-18(26(30)31)12-15(19)13-22-25-20(28)14-6-8-17(9-7-14)24-21(29)23-16-4-2-1-3-5-16/h1-13,27H,(H,25,28)(H2,23,24,29)/p-1/b22-13+