2-[3-[(2R)-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoylamino]ethylazanium

Systemtic Name: 2-[3-[(2R)-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoylamino]ethylazanium Openeye Name: 2-[3-[(2R)-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]propanoylamino]ethylammonium CAS Name: 2-[[3-[(2R)-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]-1-oxopropyl]amino]ethylammonium IUPAC Name: 2-[3-[(2R)-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]propanoylamino]ethylazanium Traditional Name: 2-[3-[(2R)-2-ethyl-3-keto-1,4-benzoxazin-4-yl]propanoylamino]ethylammonium Formula: C15H22N3O3+ MolecularWeight: 292.35348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCC[NH3+]

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCC[NH3+]

InChI

InChI=1S/C15H21N3O3/c1-2-12-15(20)18(10-7-14(19)17-9-8-16)11-5-3-4-6-13(11)21-12/h3-6,12H,2,7-10,16H2,1H3,(H,17,19)/p+1/t12-/m1/s1