2-[bis(2-chloroethyl)amino]-4,5-dinitro-benzamide

Systemtic Name: 2-[bis(2-chloroethyl)amino]-4,5-dinitro-benzamide Openeye Name: 2-[bis(2-chloroethyl)amino]-4,5-dinitro-benzamide CAS Name: 2-[bis(2-chloroethyl)amino]-4,5-dinitrobenzamide IUPAC Name: 2-[bis(2-chloroethyl)amino]-4,5-dinitrobenzamide Traditional Name: 2-[bis(2-chloroethyl)amino]-4,5-dinitro-benzamide Formula: C11H12Cl2N4O5 MolecularWeight: 351.14278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12Cl2N4O5/c12-1-3-15(4-2-13)8-6-10(17(21)22)9(16(19)20)5-7(8)11(14)18/h5-6H,1-4H2,(H2,14,18)