N-[4-[[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide

Systemtic Name: N-[4-[[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Openeye Name: N-[4-[[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide CAS Name: N-[4-[[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: N-[4-[[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Traditional Name: N-[4-[[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC=C3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC=C3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O5/c26-19-11-10-18(25(29)30)12-16(19)13-22-24-21(28)15-6-8-17(9-7-15)23-20(27)14-4-2-1-3-5-14/h1-13,22H,(H,23,27)(H,24,28)