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

Systemtic Name: [2-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]methylazanium Openeye Name: [2-oxo-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]methylammonium CAS Name: [2-oxo-3-(1-piperidin-1-iumylmethyl)-1H-quinolin-6-yl]methylammonium IUPAC Name: [2-oxo-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]methylazanium Traditional Name: [2-keto-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-6-yl]methylammonium Formula: C16H23N3O+2 MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O/c17-10-12-4-5-15-13(8-12)9-14(16(20)18-15)11-19-6-2-1-3-7-19/h4-5,8-9H,1-3,6-7,10-11,17H2,(H,18,20)/p+2