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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N(CCCl)CCCl)[N+](=O)[O-])[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=C(C(=CC(=C1N(CCCl)CCCl)[N+](=O)[O-])[N+](=O)[O-])C(=O)N

InChI

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