[(1S)-1-[2-[(4-methyl-3-oxidanyl-phenyl)carbonylamino]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-[(4-methyl-3-oxidanyl-phenyl)carbonylamino]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-[(3-hydroxy-4-methyl-benzoyl)amino]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-[[(3-hydroxy-4-methylphenyl)-oxomethyl]amino]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-[(3-hydroxy-4-methylbenzoyl)amino]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-[(3-hydroxy-4-methyl-benzoyl)amino]phenyl]ethyl]ammonium Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(C)[NH3+])O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2[C@H](C)[NH3+])O

InChI

InChI=1S/C16H18N2O2/c1-10-7-8-12(9-15(10)19)16(20)18-14-6-4-3-5-13(14)11(2)17/h3-9,11,19H,17H2,1-2H3,(H,18,20)/p+1/t11-/m0/s1