2-(3-morpholin-4-ium-4-ylpropylamino)-5-nitro-benzamide

Systemtic Name: 2-(3-morpholin-4-ium-4-ylpropylamino)-5-nitro-benzamide Openeye Name: 2-(3-morpholin-4-ium-4-ylpropylamino)-5-nitro-benzamide CAS Name: 2-[3-(4-morpholin-4-iumyl)propylamino]-5-nitrobenzamide IUPAC Name: 2-(3-morpholin-4-ium-4-ylpropylamino)-5-nitrobenzamide Traditional Name: 2-(3-morpholin-4-ium-4-ylpropylamino)-5-nitro-benzamide Formula: C14H21N4O4+ MolecularWeight: 309.34094

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1COCC[NH+]1CCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C14H20N4O4/c15-14(19)12-10-11(18(20)21)2-3-13(12)16-4-1-5-17-6-8-22-9-7-17/h2-3,10,16H,1,4-9H2,(H2,15,19)/p+1