3-(1,3-benzodioxol-5-yl)-N-[(E)-(4-bromophenyl)methylideneamino]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[(E)-(4-bromophenyl)methylideneamino]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[(E)-(4-bromophenyl)methyleneamino]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[(E)-(4-bromophenyl)methylideneamino]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[(E)-(4-bromophenyl)methylideneamino]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[(E)-(4-bromobenzylidene)amino]propionamide Formula: C17H15BrN2O3 MolecularWeight: 375.2166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NN=CC3=CC=C(C=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)N/N=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN2O3/c18-14-5-1-13(2-6-14)10-19-20-17(21)8-4-12-3-7-15-16(9-12)23-11-22-15/h1-3,5-7,9-10H,4,8,11H2,(H,20,21)/b19-10+