[(1S)-1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium

Systemtic Name: [(1S)-1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[4-(2-morpholino-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[4-[2-(4-morpholinyl)-2-oxoethyl]-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[4-(2-morpholin-4-yl-2-oxoethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[3-keto-4-(2-keto-2-morpholino-ethyl)-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C17H24N3O4+ MolecularWeight: 334.39016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCOCC3)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCOCC3)[NH3+]

InChI

InChI=1S/C17H23N3O4/c1-2-13(18)12-3-4-15-14(9-12)20(17(22)11-24-15)10-16(21)19-5-7-23-8-6-19/h3-4,9,13H,2,5-8,10-11,18H2,1H3/p+1/t13-/m0/s1