4-bromanyl-3-(cyanomethyl)-2-propyl-benzenecarbonitrile

Systemtic Name: 4-bromanyl-3-(cyanomethyl)-2-propyl-benzenecarbonitrile Openeye Name: 4-bromo-3-(cyanomethyl)-2-propyl-benzonitrile CAS Name: 4-bromo-3-(cyanomethyl)-2-propylbenzonitrile IUPAC Name: 4-bromo-3-(cyanomethyl)-2-propylbenzonitrile Traditional Name: 4-bromo-3-(cyanomethyl)-2-propyl-benzonitrile Formula: C12H11BrN2 MolecularWeight: 263.13314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1CC#N)Br)C#N

Isomeric SMILES

CCCC1=C(C=CC(=C1CC#N)Br)C#N

InChI

InChI=1S/C12H11BrN2/c1-2-3-10-9(8-15)4-5-12(13)11(10)6-7-14/h4-5H,2-3,6H2,1H3