[4-(4-methoxyphenyl)-2-thiophen-2-yl-4H-chromen-3-yl]methyl-dimethyl-azanium chloride

Systemtic Name: [4-(4-methoxyphenyl)-2-thiophen-2-yl-4H-chromen-3-yl]methyl-dimethyl-azanium chloride Openeye Name: [4-(4-methoxyphenyl)-2-(2-thienyl)-4H-chromen-3-yl]methyl-dimethyl-ammonium chloride CAS Name: [4-(4-methoxyphenyl)-2-thiophen-2-yl-4H-1-benzopyran-3-yl]methyl-dimethylammonium chloride IUPAC Name: [4-(4-methoxyphenyl)-2-thiophen-2-yl-4H-chromen-3-yl]methyl-dimethylazanium chloride Traditional Name: [4-(4-methoxyphenyl)-2-(2-thienyl)-4H-chromen-3-yl]methyl-dimethyl-ammonium chloride Formula: C23H24ClNO2S MolecularWeight: 413.96016

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(OC2=CC=CC=C2C1C3=CC=C(C=C3)OC)C4=CC=CS4.[Cl-]

Isomeric SMILES

C[NH+](C)CC1=C(OC2=CC=CC=C2C1C3=CC=C(C=C3)OC)C4=CC=CS4.[Cl-]

InChI

InChI=1S/C23H23NO2S.ClH/c1-24(2)15-19-22(16-10-12-17(25-3)13-11-16)18-7-4-5-8-20(18)26-23(19)21-9-6-14-27-21;/h4-14,22H,15H2,1-3H3;1H