1-(3-methylquinoxalin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-methylquinoxalin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-4-carboxamide Openeye Name: 1-(3-methylquinoxalin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-4-carboxamide CAS Name: 1-(3-methyl-2-quinoxalinyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-methylquinoxalin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(3-methylquinoxalin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)isonipecotamide Formula: C21H30N5O2+ MolecularWeight: 384.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C21H29N5O2/c1-16-20(24-19-5-3-2-4-18(19)23-16)26-9-6-17(7-10-26)21(27)22-8-11-25-12-14-28-15-13-25/h2-5,17H,6-15H2,1H3,(H,22,27)/p+1