4-bromanyl-N-[3-[[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-[[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Openeye Name: 4-bromo-N-[3-[[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide CAS Name: 4-bromo-N-[3-[[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 4-bromo-N-[3-[[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Traditional Name: 4-bromo-N-[3-[[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)Br)C(=O)NNC=C3C=CC(=O)C=C3O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)Br)C(=O)NNC=C3C=CC(=O)C=C3O

InChI

InChI=1S/C21H16BrN3O4/c22-16-7-4-13(5-8-16)20(28)24-17-3-1-2-14(10-17)21(29)25-23-12-15-6-9-18(26)11-19(15)27/h1-12,23,27H,(H,24,28)(H,25,29)