3-[(2R)-6-azanyl-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[(2R)-6-azanyl-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propyl-dimethyl-azanium Openeye Name: 3-[(2R)-6-amino-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]propyl-dimethyl-ammonium CAS Name: 3-[(2R)-6-amino-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]propyl-dimethylammonium IUPAC Name: 3-[(2R)-6-amino-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]propyl-dimethylazanium Traditional Name: 3-[(2R)-6-amino-2-ethyl-3-keto-1,4-benzoxazin-4-yl]propyl-dimethyl-ammonium Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)N)CCC[NH+](C)C

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)N)CCC[NH+](C)C

InChI

InChI=1S/C15H23N3O2/c1-4-13-15(19)18(9-5-8-17(2)3)12-10-11(16)6-7-14(12)20-13/h6-7,10,13H,4-5,8-9,16H2,1-3H3/p+1/t13-/m1/s1