4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]butanamide

Systemtic Name: 4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]butanamide Openeye Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[(E)-3-pyridylmethyleneamino]butanamide CAS Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[(E)-3-pyridinylmethylideneamino]butanamide IUPAC Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]butanamide Traditional Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[(E)-3-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=CN=CC=C2)Br

Isomeric SMILES

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

InChI

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