2-(2-chloroethyl)-1,3-dinitro-benzene

Systemtic Name: 2-(2-chloroethyl)-1,3-dinitro-benzene Openeye Name: 2-(2-chloroethyl)-1,3-dinitro-benzene CAS Name: 2-(2-chloroethyl)-1,3-dinitrobenzene IUPAC Name: 2-(2-chloroethyl)-1,3-dinitrobenzene Traditional Name: 2-(2-chloroethyl)-1,3-dinitro-benzene Formula: C8H7ClN2O4 MolecularWeight: 230.60518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7ClN2O4/c9-5-4-6-7(10(12)13)2-1-3-8(6)11(14)15/h1-3H,4-5H2