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

Systemtic Name: 5-bromanyl-4-(cyanomethyl)-2-propyl-benzenecarbonitrile Openeye Name: 5-bromo-4-(cyanomethyl)-2-propyl-benzonitrile CAS Name: 5-bromo-4-(cyanomethyl)-2-propylbenzonitrile IUPAC Name: 5-bromo-4-(cyanomethyl)-2-propylbenzonitrile Traditional Name: 5-bromo-4-(cyanomethyl)-2-propyl-benzonitrile Formula: C12H11BrN2 MolecularWeight: 263.13314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C#N)Br)CC#N

Isomeric SMILES

CCCC1=CC(=C(C=C1C#N)Br)CC#N

InChI

InChI=1S/C12H11BrN2/c1-2-3-9-6-10(4-5-14)12(13)7-11(9)8-15/h6-7H,2-4H2,1H3