N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]quinoline-2-carboxamide

Systemtic Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]quinoline-2-carboxamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]quinoline-2-carboxamide CAS Name: N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]-2-quinolinecarboxamide IUPAC Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]quinoline-2-carboxamide Traditional Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]quinaldamide Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H25N3O2/c1-17-6-8-19(9-7-17)22(16-26-12-14-28-15-13-26)25-23(27)21-11-10-18-4-2-3-5-20(18)24-21/h2-11,22H,12-16H2,1H3,(H,25,27)/p+1/t22-/m0/s1