N-[4-[4-(3-bromanylphenoxy)butanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[4-(3-bromanylphenoxy)butanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[4-(3-bromophenoxy)butanoylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[4-(3-bromophenoxy)-1-oxobutyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[4-(3-bromophenoxy)butanoylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[4-(3-bromophenoxy)butanoylamino]phenyl]-2-furamide Formula: C21H19BrN2O4 MolecularWeight: 443.29056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCCCC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCCCC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H19BrN2O4/c22-15-4-1-5-18(14-15)27-12-3-7-20(25)23-16-8-10-17(11-9-16)24-21(26)19-6-2-13-28-19/h1-2,4-6,8-11,13-14H,3,7,12H2,(H,23,25)(H,24,26)