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

Systemtic Name: N-[3-[[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]heptanamide Openeye Name: N-[3-[[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]heptanamide CAS Name: N-[3-[[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-oxomethyl]phenyl]heptanamide IUPAC Name: N-[3-[[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]heptanamide Traditional Name: N-[3-[[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenyl]enanthamide Formula: C21H24BrN3O3 MolecularWeight: 446.33756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=CC=CC(=C1)C(=O)NNC=C2C=C(C=CC2=O)Br

Isomeric SMILES

CCCCCCC(=O)NC1=CC=CC(=C1)C(=O)NNC=C2C=C(C=CC2=O)Br

InChI

InChI=1S/C21H24BrN3O3/c1-2-3-4-5-9-20(27)24-18-8-6-7-15(13-18)21(28)25-23-14-16-12-17(22)10-11-19(16)26/h6-8,10-14,23H,2-5,9H2,1H3,(H,24,27)(H,25,28)