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

Systemtic Name: N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[(2R)-3-ethyl-2-(4-morpholin-4-iumyl)pentyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-[(2R)-3-ethyl-2-morpholin-4-ium-4-ylpentyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-3-(2-keto-1,3-benzoxazol-3-yl)propionamide Formula: C21H32N3O4+ MolecularWeight: 390.49648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)CCN1C2=CC=CC=C2OC1=O)[NH+]3CCOCC3

Isomeric SMILES

CCC(CC)[C@H](CNC(=O)CCN1C2=CC=CC=C2OC1=O)[NH+]3CCOCC3

InChI

InChI=1S/C21H31N3O4/c1-3-16(4-2)18(23-11-13-27-14-12-23)15-22-20(25)9-10-24-17-7-5-6-8-19(17)28-21(24)26/h5-8,16,18H,3-4,9-15H2,1-2H3,(H,22,25)/p+1/t18-/m0/s1