(4aR,8aS)-4a-ethyl-1-(2-hydroxyethyl)-6-phenylsulfanyl-3,4,8,8a-tetrahydro-2H-quinolin-7-one

Systemtic Name: (4aR,8aS)-4a-ethyl-1-(2-hydroxyethyl)-6-phenylsulfanyl-3,4,8,8a-tetrahydro-2H-quinolin-7-one Openeye Name: (4aR,8aS)-4a-ethyl-1-(2-hydroxyethyl)-6-phenylsulfanyl-3,4,8,8a-tetrahydro-2H-quinolin-7-one CAS Name: (4aR,8aS)-4a-ethyl-1-(2-hydroxyethyl)-6-(phenylthio)-3,4,8,8a-tetrahydro-2H-quinolin-7-one IUPAC Name: (4aR,8aS)-4a-ethyl-1-(2-hydroxyethyl)-6-phenylsulfanyl-3,4,8,8a-tetrahydro-2H-quinolin-7-one Traditional Name: (4aR,8aS)-4a-ethyl-1-(2-hydroxyethyl)-6-(phenylthio)-3,4,8,8a-tetrahydro-2H-quinolin-7-one Formula: C19H25NO2S MolecularWeight: 331.4723

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCCN(C1CC(=O)C(=C2)SC3=CC=CC=C3)CCO

Isomeric SMILES

CC[C@]12CCCN([C@H]1CC(=O)C(=C2)SC3=CC=CC=C3)CCO

InChI

InChI=1S/C19H25NO2S/c1-2-19-9-6-10-20(11-12-21)18(19)13-16(22)17(14-19)23-15-7-4-3-5-8-15/h3-5,7-8,14,18,21H,2,6,9-13H2,1H3/t18-,19+/m0/s1