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

Systemtic Name: 2-bromanyl-N-[3-[[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Openeye Name: 2-bromo-N-[3-[[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide CAS Name: 2-bromo-N-[3-[[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 2-bromo-N-[3-[[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Traditional Name: 2-bromo-N-[3-[[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Formula: C21H15BrN4O5 MolecularWeight: 483.2716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15BrN4O5/c22-18-7-2-1-6-17(18)21(29)24-15-5-3-4-13(10-15)20(28)25-23-12-14-11-16(26(30)31)8-9-19(14)27/h1-12,23H,(H,24,29)(H,25,28)