[(3S)-8-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl]-dipropyl-azanium chloride

Systemtic Name: [(3S)-8-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl]-dipropyl-azanium chloride Openeye Name: [(3S)-8-(2-methoxyphenyl)chroman-3-yl]-dipropyl-ammonium chloride CAS Name: [(3S)-8-(2-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl]-dipropylammonium chloride IUPAC Name: [(3S)-8-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl]-dipropylazanium chloride Traditional Name: [(3S)-8-(2-methoxyphenyl)chroman-3-yl]-dipropyl-ammonium chloride Formula: C22H30ClNO2 MolecularWeight: 375.9321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)C1CC2=CC=CC(=C2OC1)C3=CC=CC=C3OC.[Cl-]

Isomeric SMILES

CCC[NH+](CCC)[C@H]1CC2=CC=CC(=C2OC1)C3=CC=CC=C3OC.[Cl-]

InChI

InChI=1S/C22H29NO2.ClH/c1-4-13-23(14-5-2)18-15-17-9-8-11-20(22(17)25-16-18)19-10-6-7-12-21(19)24-3;/h6-12,18H,4-5,13-16H2,1-3H3;1H/t18-;/m0./s1