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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO2.ClH/c1-4-13-23(14-5-2)19-15-18-7-6-8-21(22(18)25-16-19)17-9-11-20(24-3)12-10-17;/h6-12,19H,4-5,13-16H2,1-3H3;1H/t19-;/m1./s1