2-[2-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]ethylazanium

Systemtic Name: 2-[2-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]ethylazanium Openeye Name: 2-[2-oxo-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]ethylammonium CAS Name: 2-[2-oxo-3-(1-piperidin-1-iumylmethyl)-1H-quinolin-6-yl]ethylammonium IUPAC Name: 2-[2-oxo-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]ethylazanium Traditional Name: 2-[2-keto-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]ethylammonium Formula: C17H25N3O+2 MolecularWeight: 287.3999

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC3=C(C=CC(=C3)CC[NH3+])NC2=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC3=C(C=CC(=C3)CC[NH3+])NC2=O

InChI

InChI=1S/C17H23N3O/c18-7-6-13-4-5-16-14(10-13)11-15(17(21)19-16)12-20-8-2-1-3-9-20/h4-5,10-11H,1-3,6-9,12,18H2,(H,19,21)/p+2