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

Systemtic Name: [(1S)-1-[4-[(2-methylphenyl)methyl]-3-oxidanylidene-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[4-(o-tolylmethyl)-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[4-[(2-methylphenyl)methyl]-3-oxo-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[4-[(2-methylphenyl)methyl]-3-oxo-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[3-keto-4-(2-methylbenzyl)-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC=C3C)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC=C3C)[NH3+]

InChI

InChI=1S/C19H22N2O2/c1-3-16(20)14-8-9-18-17(10-14)21(19(22)12-23-18)11-15-7-5-4-6-13(15)2/h4-10,16H,3,11-12,20H2,1-2H3/p+1/t16-/m0/s1