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

Systemtic Name: 4-nitro-N-[3-[[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Openeye Name: 4-nitro-N-[3-[[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide CAS Name: 4-nitro-N-[3-[[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 4-nitro-N-[3-[[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Traditional Name: N-[3-[[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]-4-nitro-benzamide Formula: C21H15N5O7 MolecularWeight: 449.3731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15N5O7/c27-19-9-8-18(26(32)33)11-15(19)12-22-24-21(29)14-2-1-3-16(10-14)23-20(28)13-4-6-17(7-5-13)25(30)31/h1-12,22H,(H,23,28)(H,24,29)