dimethyl-[(1S)-2-[(4-oxidanylidenechromen-2-yl)carbonylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(4-oxidanylidenechromen-2-yl)carbonylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(4-oxochromene-2-carbonyl)amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[oxo-(4-oxo-1-benzopyran-2-yl)methyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(4-oxochromene-2-carbonyl)amino]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[(4-ketochromene-2-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C20H21N2O3+ MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=O)C2=CC=CC=C2O1)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=O)C2=CC=CC=C2O1)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3/c1-22(2)16(14-8-4-3-5-9-14)13-21-20(24)19-12-17(23)15-10-6-7-11-18(15)25-19/h3-12,16H,13H2,1-2H3,(H,21,24)/p+1/t16-/m1/s1