2-azanyl-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Openeye Name: 2-amino-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile CAS Name: 2-amino-1-[3-(4-morpholin-4-iumyl)propyl]-3-pyrrolo[3,2-b]quinoxalinecarbonitrile IUPAC Name: 2-amino-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Traditional Name: 2-amino-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Formula: C18H21N6O+ MolecularWeight: 337.39894

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

Isomeric SMILES

C1COCC[NH+]1CCCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

InChI

InChI=1S/C18H20N6O/c19-12-13-16-18(22-15-5-2-1-4-14(15)21-16)24(17(13)20)7-3-6-23-8-10-25-11-9-23/h1-2,4-5H,3,6-11,20H2/p+1