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

Systemtic Name: [(1S)-1-[(2R)-4-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]ethyl]azanium Openeye Name: [(1S)-1-[(2R)-4-(2-amino-2-oxo-ethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium CAS Name: [(1S)-1-[(2R)-4-(2-amino-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]ammonium IUPAC Name: [(1S)-1-[(2R)-4-(2-amino-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]ethyl]azanium Traditional Name: [(1S)-1-[(2R)-4-(2-amino-2-keto-ethyl)-3-keto-2-methyl-1,4-benzoxazin-6-yl]ethyl]ammonium Formula: C13H18N3O3+ MolecularWeight: 264.30032

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C(C)[NH3+])CC(=O)N

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)[C@H](C)[NH3+])CC(=O)N

InChI

InChI=1S/C13H17N3O3/c1-7(14)9-3-4-11-10(5-9)16(6-12(15)17)13(18)8(2)19-11/h3-5,7-8H,6,14H2,1-2H3,(H2,15,17)/p+1/t7-,8+/m0/s1