sodium (3E)-3-[[4-[(4-azanyl-3-methyl-phenyl)carbonylamino]phenyl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: sodium (3E)-3-[[4-[(4-azanyl-3-methyl-phenyl)carbonylamino]phenyl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate Openeye Name: sodium (3E)-3-[[4-[(4-amino-3-methyl-benzoyl)amino]phenyl]hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylate CAS Name: sodium (3E)-3-[[4-[[(4-amino-3-methylphenyl)-oxomethyl]amino]phenyl]hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylate IUPAC Name: sodium (3E)-3-[[4-[(4-amino-3-methylbenzoyl)amino]phenyl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylate Traditional Name: sodium (3E)-3-[[4-[(4-amino-3-methyl-benzoyl)amino]phenyl]hydrazono]-6-keto-cyclohexa-1,4-diene-1-carboxylate Formula: C21H17N4NaO4 MolecularWeight: 412.37385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)NN=C3C=CC(=O)C(=C3)C(=O)[O-])N.[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)N/N=C/3\C=CC(=O)C(=C3)C(=O)[O-])N.[Na+]

InChI

InChI=1S/C21H18N4O4.Na/c1-12-10-13(2-8-18(12)22)20(27)23-14-3-5-15(6-4-14)24-25-16-7-9-19(26)17(11-16)21(28)29;/h2-11,24H,22H2,1H3,(H,23,27)(H,28,29);/q;+1/p-1/b25-16+;