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

Systemtic Name: [(1S)-1-[(2R)-4-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[(2R)-4-(2-amino-2-oxo-ethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[(2R)-4-(2-amino-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[(2R)-4-(2-amino-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[(2R)-4-(2-amino-2-keto-ethyl)-3-keto-2-methyl-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C14H20N3O3+ MolecularWeight: 278.3269

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)N)C)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)N)C)[NH3+]

InChI

InChI=1S/C14H19N3O3/c1-3-10(15)9-4-5-12-11(6-9)17(7-13(16)18)14(19)8(2)20-12/h4-6,8,10H,3,7,15H2,1-2H3,(H2,16,18)/p+1/t8-,10+/m1/s1