3-[(cyclohexylamino)methyl]-N-(2-hydroxyethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxamide

Systemtic Name: 3-[(cyclohexylamino)methyl]-N-(2-hydroxyethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxamide Openeye Name: 3-[(cyclohexylamino)methyl]-N-(2-hydroxyethyl)-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxamide CAS Name: 3-[(cyclohexylamino)methyl]-N-(2-hydroxyethyl)-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxamide IUPAC Name: 3-[(cyclohexylamino)methyl]-N-(2-hydroxyethyl)-4-oxido-1-oxoquinoxalin-1-ium-2-carboxamide Traditional Name: 3-[(cyclohexylamino)methyl]-N-(2-hydroxyethyl)-1-keto-4-oxido-quinoxalin-1-ium-2-carboxamide Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCC2=C([N+](=O)C3=CC=CC=C3N2[O-])C(=O)NCCO

Isomeric SMILES

C1CCC(CC1)NCC2=C([N+](=O)C3=CC=CC=C3N2[O-])C(=O)NCCO

InChI

InChI=1S/C18H24N4O4/c23-11-10-19-18(24)17-16(12-20-13-6-2-1-3-7-13)21(25)14-8-4-5-9-15(14)22(17)26/h4-5,8-9,13,20,23H,1-3,6-7,10-12H2,(H,19,24)