3-[(tert-butylamino)methyl]-N-(2-hydroxyethyl)-1,4-bis(oxidanyl)quinoxaline-1,4-diium-2-carboxamide

Systemtic Name: 3-[(tert-butylamino)methyl]-N-(2-hydroxyethyl)-1,4-bis(oxidanyl)quinoxaline-1,4-diium-2-carboxamide Openeye Name: 3-[(tert-butylamino)methyl]-1,4-dihydroxy-N-(2-hydroxyethyl)quinoxaline-1,4-diium-2-carboxamide CAS Name: 3-[(tert-butylamino)methyl]-1,4-dihydroxy-N-(2-hydroxyethyl)-2-quinoxaline-1,4-diiumcarboxamide IUPAC Name: 3-[(tert-butylamino)methyl]-1,4-dihydroxy-N-(2-hydroxyethyl)quinoxaline-1,4-diium-2-carboxamide Traditional Name: 3-[(tert-butylamino)methyl]-1,4-dihydroxy-N-(2-hydroxyethyl)quinoxaline-1,4-diium-2-carboxamide Formula: C16H24N4O4+2 MolecularWeight: 336.38616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC1=[N+](C2=CC=CC=C2[N+](=C1C(=O)NCCO)O)O

Isomeric SMILES

CC(C)(C)NCC1=[N+](C2=CC=CC=C2[N+](=C1C(=O)NCCO)O)O

InChI

InChI=1S/C16H23N4O4/c1-16(2,3)18-10-13-14(15(22)17-8-9-21)20(24)12-7-5-4-6-11(12)19(13)23/h4-7,18,21H,8-10H2,1-3H3,(H2-,17,22,23,24)/q+1/p+1