4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[(E)-pyridin-2-ylmethylideneamino]butanamide

Systemtic Name: 4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[(E)-pyridin-2-ylmethylideneamino]butanamide Openeye Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[(E)-2-pyridylmethyleneamino]butanamide CAS Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[(E)-2-pyridinylmethylideneamino]butanamide IUPAC Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[(E)-pyridin-2-ylmethylideneamino]butanamide Traditional Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[(E)-2-pyridylmethyleneamino]butyramide Formula: C20H24BrN3O2 MolecularWeight: 418.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NN=CC2=CC=CC=N2)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)N/N=C/C2=CC=CC=N2)Br

InChI

InChI=1S/C20H24BrN3O2/c1-20(2,3)15-9-10-18(17(21)13-15)26-12-6-8-19(25)24-23-14-16-7-4-5-11-22-16/h4-5,7,9-11,13-14H,6,8,12H2,1-3H3,(H,24,25)/b23-14+