2-[[4-[4-(ethylcarbamoyl)piperidin-1-yl]-3-nitro-phenyl]sulfonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[4-[4-(ethylcarbamoyl)piperidin-1-yl]-3-nitro-phenyl]sulfonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[4-[4-(ethylcarbamoyl)-1-piperidyl]-3-nitro-phenyl]sulfonylamino]ethyl-diisopropyl-ammonium CAS Name: 2-[[4-[4-(ethylcarbamoyl)-1-piperidinyl]-3-nitrophenyl]sulfonylamino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[4-[4-(ethylcarbamoyl)piperidin-1-yl]-3-nitrophenyl]sulfonylamino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[4-[4-(ethylcarbamoyl)piperidino]-3-nitro-phenyl]sulfonylamino]ethyl-diisopropyl-ammonium Formula: C22H38N5O5S+ MolecularWeight: 484.63262

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NCC[NH+](C(C)C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NCC[NH+](C(C)C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H37N5O5S/c1-6-23-22(28)18-9-12-25(13-10-18)20-8-7-19(15-21(20)27(29)30)33(31,32)24-11-14-26(16(2)3)17(4)5/h7-8,15-18,24H,6,9-14H2,1-5H3,(H,23,28)/p+1