4-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanenitrile

Systemtic Name: 4-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanenitrile Openeye Name: 4-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-4-oxo-butanenitrile CAS Name: 4-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-4-oxobutanenitrile IUPAC Name: 4-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-4-oxobutanenitrile Traditional Name: 4-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-4-keto-butyronitrile Formula: C18H16BrNO3 MolecularWeight: 374.22854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Br)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Br)C#N)OC

InChI

InChI=1S/C18H16BrNO3/c1-22-17-8-5-13(10-18(17)23-2)14(11-20)9-16(21)12-3-6-15(19)7-4-12/h3-8,10,14H,9H2,1-2H3