2-azanyl-1-(3-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(3-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(3-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3-fluorophenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C23H24FN6O2+ MolecularWeight: 435.474063

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC(=CC=C5)F)N

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC(=CC=C5)F)N

InChI

InChI=1S/C23H23FN6O2/c24-15-4-3-5-16(14-15)30-21(25)19(23(31)26-8-9-29-10-12-32-13-11-29)20-22(30)28-18-7-2-1-6-17(18)27-20/h1-7,14H,8-13,25H2,(H,26,31)/p+1