(Z)-1-(1,3-benzodioxol-5-yl)-3-[(2-bromanyl-4-nitro-phenyl)amino]prop-2-en-1-one

Systemtic Name: (Z)-1-(1,3-benzodioxol-5-yl)-3-[(2-bromanyl-4-nitro-phenyl)amino]prop-2-en-1-one Openeye Name: (Z)-1-(1,3-benzodioxol-5-yl)-3-(2-bromo-4-nitro-anilino)prop-2-en-1-one CAS Name: (Z)-1-(1,3-benzodioxol-5-yl)-3-(2-bromo-4-nitroanilino)-2-propen-1-one IUPAC Name: (Z)-1-(1,3-benzodioxol-5-yl)-3-(2-bromo-4-nitroanilino)prop-2-en-1-one Traditional Name: (Z)-1-(1,3-benzodioxol-5-yl)-3-(2-bromo-4-nitro-anilino)prop-2-en-1-one Formula: C16H11BrN2O5 MolecularWeight: 391.17294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C=CNC3=C(C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)/C=C\NC3=C(C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H11BrN2O5/c17-12-8-11(19(21)22)2-3-13(12)18-6-5-14(20)10-1-4-15-16(7-10)24-9-23-15/h1-8,18H,9H2/b6-5-