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

Systemtic Name: 4-bromanyl-N-[2-[[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Openeye Name: 4-bromo-N-[2-[[(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide CAS Name: 4-bromo-N-[2-[[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 4-bromo-N-[2-[[(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenyl]benzamide Traditional Name: 4-bromo-N-[2-[[(3-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=C(C(=C1)C(=O)NNC=C2C=CC(=O)C(=C2)O)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC=C2C=CC(=O)C(=C2)O)NC(=O)C3=CC=C(C=C3)Br

InChI

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