2-(azepan-1-ium-1-yl)-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)acetamide Formula: C20H28N4O+2 MolecularWeight: 340.46252

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C3=CC=CC=C3[NH+]=C21)NC(=O)C[NH+]4CCCCCC4

Isomeric SMILES

CN1CCC2=C(C3=CC=CC=C3[NH+]=C21)NC(=O)C[NH+]4CCCCCC4

InChI

InChI=1S/C20H26N4O/c1-23-13-10-16-19(15-8-4-5-9-17(15)21-20(16)23)22-18(25)14-24-11-6-2-3-7-12-24/h4-5,8-9H,2-3,6-7,10-14H2,1H3,(H,21,22,25)/p+2