2-(1,4-diazepan-4-ium-1-yl)quinoline

Systemtic Name: 2-(1,4-diazepan-4-ium-1-yl)quinoline Openeye Name: 2-(1,4-diazepan-4-ium-1-yl)quinoline CAS Name: 2-(1,4-diazepan-4-ium-1-yl)quinoline IUPAC Name: 2-(1,4-diazepan-4-ium-1-yl)quinoline Traditional Name: 2-(1,4-diazepan-4-ium-1-yl)quinoline Formula: C14H18N3+ MolecularWeight: 228.31282

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C1C[NH2+]CCN(C1)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C14H17N3/c1-2-5-13-12(4-1)6-7-14(16-13)17-10-3-8-15-9-11-17/h1-2,4-7,15H,3,8-11H2/p+1