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

Systemtic Name: 3-[(2R)-6-azanyl-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]propyl-dimethyl-azanium Openeye Name: 3-[(2R)-6-amino-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl]propyl-dimethyl-ammonium CAS Name: 3-[(2R)-6-amino-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propyl-dimethylammonium IUPAC Name: 3-[(2R)-6-amino-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propyl-dimethylazanium Traditional Name: 3-[(2R)-6-amino-2-isopropyl-3-keto-1,4-benzoxazin-4-yl]propyl-dimethyl-ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=C(O1)C=CC(=C2)N)CCC[NH+](C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O2/c1-11(2)15-16(20)19(9-5-8-18(3)4)13-10-12(17)6-7-14(13)21-15/h6-7,10-11,15H,5,8-9,17H2,1-4H3/p+1/t15-/m1/s1