3-(cyanomethyl)-2-nitro-4,6-dipropyl-benzenecarbonitrile

Systemtic Name: 3-(cyanomethyl)-2-nitro-4,6-dipropyl-benzenecarbonitrile Openeye Name: 3-(cyanomethyl)-2-nitro-4,6-dipropyl-benzonitrile CAS Name: 3-(cyanomethyl)-2-nitro-4,6-dipropylbenzonitrile IUPAC Name: 3-(cyanomethyl)-2-nitro-4,6-dipropylbenzonitrile Traditional Name: 3-(cyanomethyl)-2-nitro-4,6-dipropyl-benzonitrile Formula: C15H17N3O2 MolecularWeight: 271.31438

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1C#N)[N+](=O)[O-])CC#N)CCC

Isomeric SMILES

CCCC1=CC(=C(C(=C1C#N)[N+](=O)[O-])CC#N)CCC

InChI

InChI=1S/C15H17N3O2/c1-3-5-11-9-12(6-4-2)14(10-17)15(18(19)20)13(11)7-8-16/h9H,3-7H2,1-2H3