[(4S)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl-dimethyl-azanium

Systemtic Name: [(4S)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl-dimethyl-azanium Openeye Name: [(4S)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl-dimethyl-ammonium CAS Name: [(4S)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-1-benzopyran-3-yl]methyl-dimethylammonium IUPAC Name: [(4S)-2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl-dimethylazanium Traditional Name: [(4S)-4-(4-fluorophenyl)-2-p-phenetyl-4H-chromen-3-yl]methyl-dimethyl-ammonium Formula: C26H27FNO2+ MolecularWeight: 404.496483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(C(C3=CC=CC=C3O2)C4=CC=C(C=C4)F)C[NH+](C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C([C@H](C3=CC=CC=C3O2)C4=CC=C(C=C4)F)C[NH+](C)C

InChI

InChI=1S/C26H26FNO2/c1-4-29-21-15-11-19(12-16-21)26-23(17-28(2)3)25(18-9-13-20(27)14-10-18)22-7-5-6-8-24(22)30-26/h5-16,25H,4,17H2,1-3H3/p+1/t25-/m0/s1