3-methyl-N-[(2R)-1-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[(2R)-1-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 3-methyl-N-[(1R)-1-methyl-2-[(6-morpholinopyridin-1-ium-3-yl)methylamino]-2-oxo-ethyl]benzamide CAS Name: 3-methyl-N-[(2R)-1-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methylamino]-1-oxopropan-2-yl]benzamide IUPAC Name: 3-methyl-N-[(2R)-1-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]-1-oxopropan-2-yl]benzamide Traditional Name: N-[(1R)-2-keto-1-methyl-2-[(6-morpholinopyridin-1-ium-3-yl)methylamino]ethyl]-3-methyl-benzamide Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@H](C)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H26N4O3/c1-15-4-3-5-18(12-15)21(27)24-16(2)20(26)23-14-17-6-7-19(22-13-17)25-8-10-28-11-9-25/h3-7,12-13,16H,8-11,14H2,1-2H3,(H,23,26)(H,24,27)/p+1/t16-/m1/s1