N-(3-morpholin-4-ylpropyl)-2,4-dinitro-aniline chloride

Systemtic Name: N-(3-morpholin-4-ylpropyl)-2,4-dinitro-aniline chloride Openeye Name: N-(3-morpholinopropyl)-2,4-dinitro-aniline chloride CAS Name: N-[3-(4-morpholinyl)propyl]-2,4-dinitroaniline chloride IUPAC Name: N-(3-morpholin-4-ylpropyl)-2,4-dinitroaniline chloride Traditional Name: (2,4-dinitrophenyl)-(3-morpholinopropyl)amine chloride Formula: C13H18ClN4O5- MolecularWeight: 345.75882

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1COCCN1CCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C13H18N4O5.ClH/c18-16(19)11-2-3-12(13(10-11)17(20)21)14-4-1-5-15-6-8-22-9-7-15;/h2-3,10,14H,1,4-9H2;1H/p-1