[(1S)-1-(3-fluorophenyl)-2-[(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(3-fluorophenyl)-2-[(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(3-fluorophenyl)-2-[(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(3-fluorophenyl)-2-[[(3-methyl-4-oxo-2-phenyl-1-benzopyran-8-yl)-oxomethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(3-fluorophenyl)-2-[(3-methyl-4-oxo-2-phenylchromene-8-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(3-fluorophenyl)-2-[(4-keto-3-methyl-2-phenyl-chromene-8-carbonyl)amino]ethyl]-dimethyl-ammonium Formula: C27H26FN2O3+ MolecularWeight: 445.505343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCC(C3=CC(=CC=C3)F)[NH+](C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC[C@H](C3=CC(=CC=C3)F)[NH+](C)C)C4=CC=CC=C4

InChI

InChI=1S/C27H25FN2O3/c1-17-24(31)21-13-8-14-22(26(21)33-25(17)18-9-5-4-6-10-18)27(32)29-16-23(30(2)3)19-11-7-12-20(28)15-19/h4-15,23H,16H2,1-3H3,(H,29,32)/p+1/t23-/m1/s1