5-bromanyl-4-(cyanomethyl)-2-propan-2-yl-benzenecarbonitrile

Systemtic Name: 5-bromanyl-4-(cyanomethyl)-2-propan-2-yl-benzenecarbonitrile Openeye Name: 5-bromo-4-(cyanomethyl)-2-isopropyl-benzonitrile CAS Name: 5-bromo-4-(cyanomethyl)-2-propan-2-ylbenzonitrile IUPAC Name: 5-bromo-4-(cyanomethyl)-2-propan-2-ylbenzonitrile Traditional Name: 5-bromo-4-(cyanomethyl)-2-isopropyl-benzonitrile Formula: C12H11BrN2 MolecularWeight: 263.13314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1C#N)Br)CC#N

Isomeric SMILES

CC(C)C1=CC(=C(C=C1C#N)Br)CC#N

InChI

InChI=1S/C12H11BrN2/c1-8(2)11-5-9(3-4-14)12(13)6-10(11)7-15/h5-6,8H,3H2,1-2H3