2-(3-bromanyl-1,4-dimethoxy-naphthalen-2-yl)-2-(1,3-dithiolan-2-ylidene)ethanenitrile

Systemtic Name: 2-(3-bromanyl-1,4-dimethoxy-naphthalen-2-yl)-2-(1,3-dithiolan-2-ylidene)ethanenitrile Openeye Name: 2-(3-bromo-1,4-dimethoxy-2-naphthyl)-2-(1,3-dithiolan-2-ylidene)acetonitrile CAS Name: 2-(3-bromo-1,4-dimethoxy-2-naphthalenyl)-2-(1,3-dithiolan-2-ylidene)acetonitrile IUPAC Name: 2-(3-bromo-1,4-dimethoxynaphthalen-2-yl)-2-(1,3-dithiolan-2-ylidene)acetonitrile Traditional Name: 2-(3-bromo-1,4-dimethoxy-2-naphthyl)-2-(1,3-dithiolan-2-ylidene)acetonitrile Formula: C17H14BrNO2S2 MolecularWeight: 408.33256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=CC=CC=C21)OC)Br)C(=C3SCCS3)C#N

Isomeric SMILES

COC1=C(C(=C(C2=CC=CC=C21)OC)Br)C(=C3SCCS3)C#N

InChI

InChI=1S/C17H14BrNO2S2/c1-20-15-10-5-3-4-6-11(10)16(21-2)14(18)13(15)12(9-19)17-22-7-8-23-17/h3-6H,7-8H2,1-2H3