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

Systemtic Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]propionamide Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC(=O)CCN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

C1COCC[NH+]1C[C@@H](C2=CC=CC=C2)NC(=O)CCN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O4/c27-22(10-11-26-20-8-4-5-9-21(20)30-17-23(26)28)24-19(18-6-2-1-3-7-18)16-25-12-14-29-15-13-25/h1-9,19H,10-17H2,(H,24,27)/p+1/t19-/m0/s1