2-(2-hydroxyethylamino)-1,1,4-trimethyl-5-nitro-N-phenyl-piperazin-1-ium-2-carboxamide

Systemtic Name: 2-(2-hydroxyethylamino)-1,1,4-trimethyl-5-nitro-N-phenyl-piperazin-1-ium-2-carboxamide Openeye Name: 2-(2-hydroxyethylamino)-1,1,4-trimethyl-5-nitro-N-phenyl-piperazin-1-ium-2-carboxamide CAS Name: 2-(2-hydroxyethylamino)-1,1,4-trimethyl-5-nitro-N-phenyl-2-piperazin-1-iumcarboxamide IUPAC Name: 2-(2-hydroxyethylamino)-1,1,4-trimethyl-5-nitro-N-phenylpiperazin-1-ium-2-carboxamide Traditional Name: 2-(2-hydroxyethylamino)-1,1,4-trimethyl-5-nitro-N-phenyl-piperazin-1-ium-2-carboxamide Formula: C16H26N5O4+ MolecularWeight: 352.40874

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC([N+](CC1[N+](=O)[O-])(C)C)(C(=O)NC2=CC=CC=C2)NCCO

Isomeric SMILES

CN1CC([N+](CC1[N+](=O)[O-])(C)C)(C(=O)NC2=CC=CC=C2)NCCO

InChI

InChI=1S/C16H25N5O4/c1-19-12-16(17-9-10-22,21(2,3)11-14(19)20(24)25)15(23)18-13-7-5-4-6-8-13/h4-8,14,17,22H,9-12H2,1-3H3/p+1