3-chloranyl-2,6-dinitro-5-propan-2-yl-benzenecarbonitrile

Systemtic Name: 3-chloranyl-2,6-dinitro-5-propan-2-yl-benzenecarbonitrile Openeye Name: 3-chloro-5-isopropyl-2,6-dinitro-benzonitrile CAS Name: 3-chloro-2,6-dinitro-5-propan-2-ylbenzonitrile IUPAC Name: 3-chloro-2,6-dinitro-5-propan-2-ylbenzonitrile Traditional Name: 3-chloro-5-isopropyl-2,6-dinitro-benzonitrile Formula: C10H8ClN3O4 MolecularWeight: 269.64122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1[N+](=O)[O-])C#N)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1[N+](=O)[O-])C#N)[N+](=O)[O-])Cl

InChI

InChI=1S/C10H8ClN3O4/c1-5(2)6-3-8(11)10(14(17)18)7(4-12)9(6)13(15)16/h3,5H,1-2H3