N-(2-morpholin-4-ium-4-ylethyl)-2-nitro-5-piperazin-4-ium-1-yl-aniline

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-2-nitro-5-piperazin-4-ium-1-yl-aniline Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-2-nitro-5-piperazin-4-ium-1-yl-aniline CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-2-nitro-5-(1-piperazin-4-iumyl)aniline IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-2-nitro-5-piperazin-4-ium-1-ylaniline Traditional Name: 2-morpholin-4-ium-4-ylethyl-(2-nitro-5-piperazin-4-ium-1-yl-phenyl)amine Formula: C16H27N5O3+2 MolecularWeight: 337.41728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC[NH+]3CCOCC3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC[NH+]3CCOCC3

InChI

InChI=1S/C16H25N5O3/c22-21(23)16-2-1-14(20-7-3-17-4-8-20)13-15(16)18-5-6-19-9-11-24-12-10-19/h1-2,13,17-18H,3-12H2/p+2