N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: 3-morpholin-4-ium-4-ylpropyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C17H27N4O5S+ MolecularWeight: 399.48508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCCC[NH+]3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCCC[NH+]3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O5S/c22-21(23)17-14-15(27(24,25)20-8-1-2-9-20)4-5-16(17)18-6-3-7-19-10-12-26-13-11-19/h4-5,14,18H,1-3,6-13H2/p+1