N'-(2-methylquinolin-4-yl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]ethanediamide

Systemtic Name: N'-(2-methylquinolin-4-yl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]ethanediamide Openeye Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-N'-(2-methyl-4-quinolyl)oxamide CAS Name: N'-(2-methyl-4-quinolinyl)-N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]oxamide IUPAC Name: N'-(2-methylquinolin-4-yl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]oxamide Traditional Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-N'-(2-methyl-4-quinolyl)oxamide Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(=O)NCC3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(=O)NCC3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C21H28N4O2/c1-14(2)25-10-8-16(9-11-25)13-22-20(26)21(27)24-19-12-15(3)23-18-7-5-4-6-17(18)19/h4-7,12,14,16H,8-11,13H2,1-3H3,(H,22,26)(H,23,24,27)/p+1