3-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propyl-dimethyl-azanium hydrochloride

Systemtic Name: 3-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propyl-dimethyl-azanium hydrochloride Openeye Name: 3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-dimethyl-ammonium hydrochloride CAS Name: 3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-dimethylammonium hydrochloride IUPAC Name: 3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl-dimethylazanium hydrochloride Traditional Name: 3-(6-chloro-3-keto-2-methyl-1,4-benzoxazin-4-yl)propyl-dimethyl-ammonium hydrochloride Formula: C14H21Cl2N2O2+ MolecularWeight: 320.23474

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCC[NH+](C)C.Cl

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCC[NH+](C)C.Cl

InChI

InChI=1S/C14H19ClN2O2.ClH/c1-10-14(18)17(8-4-7-16(2)3)12-9-11(15)5-6-13(12)19-10;/h5-6,9-10H,4,7-8H2,1-3H3;1H/p+1