3-bromanyl-4-(cyanomethyl)-2,5-dipropyl-benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-(cyanomethyl)-2,5-dipropyl-benzenecarbonitrile Openeye Name: 3-bromo-4-(cyanomethyl)-2,5-dipropyl-benzonitrile CAS Name: 3-bromo-4-(cyanomethyl)-2,5-dipropylbenzonitrile IUPAC Name: 3-bromo-4-(cyanomethyl)-2,5-dipropylbenzonitrile Traditional Name: 3-bromo-4-(cyanomethyl)-2,5-dipropyl-benzonitrile Formula: C15H17BrN2 MolecularWeight: 305.21288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C(=C1)C#N)CCC)Br)CC#N

Isomeric SMILES

CCCC1=C(C(=C(C(=C1)C#N)CCC)Br)CC#N

InChI

InChI=1S/C15H17BrN2/c1-3-5-11-9-12(10-18)13(6-4-2)15(16)14(11)7-8-17/h9H,3-7H2,1-2H3