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

Systemtic Name: [(1S)-1-[2,2-dimethyl-3-oxidanylidene-4-(phenylmethyl)-1,4-benzoxazin-6-yl]ethyl]azanium Openeye Name: [(1S)-1-(4-benzyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl)ethyl]ammonium CAS Name: [(1S)-1-[2,2-dimethyl-3-oxo-4-(phenylmethyl)-1,4-benzoxazin-6-yl]ethyl]ammonium IUPAC Name: [(1S)-1-(4-benzyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl)ethyl]azanium Traditional Name: [(1S)-1-(4-benzyl-3-keto-2,2-dimethyl-1,4-benzoxazin-6-yl)ethyl]ammonium Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OC(C(=O)N2CC3=CC=CC=C3)(C)C)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OC(C(=O)N2CC3=CC=CC=C3)(C)C)[NH3+]

InChI

InChI=1S/C19H22N2O2/c1-13(20)15-9-10-17-16(11-15)21(18(22)19(2,3)23-17)12-14-7-5-4-6-8-14/h4-11,13H,12,20H2,1-3H3/p+1/t13-/m0/s1