4-(3-bromanyl-4-methoxy-phenyl)-3-oxidanylidene-2-(triphenyl-$l^{5}-phosphanylidene)butanenitrile

Systemtic Name: 4-(3-bromanyl-4-methoxy-phenyl)-3-oxidanylidene-2-(triphenyl-$l^{5}-phosphanylidene)butanenitrile Openeye Name: 4-(3-bromo-4-methoxy-phenyl)-3-oxo-2-(triphenyl-$l^{5}-phosphanylidene)butanenitrile CAS Name: 4-(3-bromo-4-methoxyphenyl)-3-oxo-2-triphenylphosphoranylidenebutanenitrile IUPAC Name: 4-(3-bromo-4-methoxyphenyl)-3-oxo-2-(triphenyl-$l^{5}-phosphanylidene)butanenitrile Traditional Name: 4-(3-bromo-4-methoxy-phenyl)-3-keto-2-triphenylphosphoranylidene-butyronitrile Formula: C29H23BrNO2P MolecularWeight: 528.376181

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N)Br

InChI

InChI=1S/C29H23BrNO2P/c1-33-28-18-17-22(19-26(28)30)20-27(32)29(21-31)34(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-19H,20H2,1H3