(E)-3-(4-bromophenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-bromophenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile Openeye Name: (E)-3-(4-bromophenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-3-(4-bromophenyl)-2-(4,5-dimethoxy-2-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-3-(4-bromophenyl)-2-(4,5-dimethoxy-2-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-3-(4-bromophenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)acrylonitrile Formula: C17H13BrN2O4 MolecularWeight: 389.20012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=CC2=CC=C(C=C2)Br)C#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C(=C\C2=CC=C(C=C2)Br)/C#N)[N+](=O)[O-])OC

InChI

InChI=1S/C17H13BrN2O4/c1-23-16-8-14(15(20(21)22)9-17(16)24-2)12(10-19)7-11-3-5-13(18)6-4-11/h3-9H,1-2H3/b12-7-