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

Systemtic Name: 5-[bis(2-hydroxyethyl)amino]-2,4-dinitro-benzamide Openeye Name: 5-[bis(2-hydroxyethyl)amino]-2,4-dinitro-benzamide CAS Name: 5-[bis(2-hydroxyethyl)amino]-2,4-dinitrobenzamide IUPAC Name: 5-[bis(2-hydroxyethyl)amino]-2,4-dinitrobenzamide Traditional Name: 5-[bis(2-hydroxyethyl)amino]-2,4-dinitro-benzamide Formula: C11H14N4O7 MolecularWeight: 314.25146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N4O7/c12-11(18)7-5-9(13(1-3-16)2-4-17)10(15(21)22)6-8(7)14(19)20/h5-6,16-17H,1-4H2,(H2,12,18)