N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]-5-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]-5-nitro-pyridin-1-ium-2-amine Openeye Name: N-[2-(4-morpholinosulfonylphenyl)ethyl]-5-nitro-pyridin-1-ium-2-amine CAS Name: N-[2-[4-(4-morpholinylsulfonyl)phenyl]ethyl]-5-nitro-2-pyridin-1-iumamine IUPAC Name: N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]-5-nitropyridin-1-ium-2-amine Traditional Name: 2-(4-morpholinosulfonylphenyl)ethyl-(5-nitropyridin-1-ium-2-yl)amine Formula: C17H21N4O5S+ MolecularWeight: 393.43744

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCNC3=[NH+]C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCNC3=[NH+]C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O5S/c22-21(23)15-3-6-17(19-13-15)18-8-7-14-1-4-16(5-2-14)27(24,25)20-9-11-26-12-10-20/h1-6,13H,7-12H2,(H,18,19)/p+1