4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[(E)-(4-propoxyphenyl)methylideneamino]butanamide

Systemtic Name: 4-(2-bromanyl-4-tert-butyl-phenoxy)-N-[(E)-(4-propoxyphenyl)methylideneamino]butanamide Openeye Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[(E)-(4-propoxyphenyl)methyleneamino]butanamide CAS Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[(E)-(4-propoxyphenyl)methylideneamino]butanamide IUPAC Name: 4-(2-bromo-4-tert-butylphenoxy)-N-[(E)-(4-propoxyphenyl)methylideneamino]butanamide Traditional Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-[(E)-(4-propoxybenzylidene)amino]butyramide Formula: C24H31BrN2O3 MolecularWeight: 475.41854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=NNC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=N/NC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C24H31BrN2O3/c1-5-14-29-20-11-8-18(9-12-20)17-26-27-23(28)7-6-15-30-22-13-10-19(16-21(22)25)24(2,3)4/h8-13,16-17H,5-7,14-15H2,1-4H3,(H,27,28)/b26-17+