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

Systemtic Name: [(1S)-1-[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[4-(2-hydroxyethyl)-3-keto-2,2-dimethyl-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OC(C(=O)N2CCO)(C)C)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OC(C(=O)N2CCO)(C)C)[NH3+]

InChI

InChI=1S/C15H22N2O3/c1-4-11(16)10-5-6-13-12(9-10)17(7-8-18)14(19)15(2,3)20-13/h5-6,9,11,18H,4,7-8,16H2,1-3H3/p+1/t11-/m0/s1