N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-[(2S)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanamide

Systemtic Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-[(2S)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetamide CAS Name: N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetamide IUPAC Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]-2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetamide Traditional Name: 2-[(2S)-3-keto-4H-1,4-benzoxazin-2-yl]-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide Formula: C22H26N3O4+ MolecularWeight: 396.45954

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC(=O)CC3C(=O)NC4=CC=CC=C4O3

Isomeric SMILES

C1COCC[NH+]1C[C@@H](C2=CC=CC=C2)NC(=O)C[C@H]3C(=O)NC4=CC=CC=C4O3

InChI

InChI=1S/C22H25N3O4/c26-21(14-20-22(27)24-17-8-4-5-9-19(17)29-20)23-18(16-6-2-1-3-7-16)15-25-10-12-28-13-11-25/h1-9,18,20H,10-15H2,(H,23,26)(H,24,27)/p+1/t18-,20-/m0/s1