(Z)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-(6-bromo-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-(6-bromo-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-(6-bromo-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-(6-bromo-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)acrylonitrile Formula: C16H9BrN2O4 MolecularWeight: 373.15766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9BrN2O4/c17-14-7-16-15(22-9-23-16)6-11(14)5-12(8-18)10-1-3-13(4-2-10)19(20)21/h1-7H,9H2/b12-5+