[(1R)-1-(4-methoxyphenyl)-2-[(4-oxidanylidenechromen-2-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(4-methoxyphenyl)-2-[(4-oxidanylidenechromen-2-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(4-methoxyphenyl)-2-[(4-oxochromene-2-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(4-methoxyphenyl)-2-[[oxo-(4-oxo-1-benzopyran-2-yl)methyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(4-methoxyphenyl)-2-[(4-oxochromene-2-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1R)-2-[(4-ketochromene-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C21H23N2O4+ MolecularWeight: 367.41832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4/c1-23(2)17(14-8-10-15(26-3)11-9-14)13-22-21(25)20-12-18(24)16-6-4-5-7-19(16)27-20/h4-12,17H,13H2,1-3H3,(H,22,25)/p+1/t17-/m0/s1