[(2S,3S,4S)-4-(3-bromanylpropoxy)-2-methyl-3-oxidanyl-3,4-dihydro-2H-quinolin-1-yl]-(4-methylphenyl)methanone

Systemtic Name: [(2S,3S,4S)-4-(3-bromanylpropoxy)-2-methyl-3-oxidanyl-3,4-dihydro-2H-quinolin-1-yl]-(4-methylphenyl)methanone Openeye Name: [(2S,3S,4S)-4-(3-bromopropoxy)-3-hydroxy-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-(p-tolyl)methanone CAS Name: [(2S,3S,4S)-4-(3-bromopropoxy)-3-hydroxy-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-(4-methylphenyl)methanone IUPAC Name: [(2S,3S,4S)-4-(3-bromopropoxy)-3-hydroxy-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-(4-methylphenyl)methanone Traditional Name: [(2S,3S,4S)-4-(3-bromopropoxy)-3-hydroxy-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-(p-tolyl)methanone Formula: C21H24BrNO3 MolecularWeight: 418.32416

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)C)OCCCBr)O

Isomeric SMILES

C[C@H]1[C@@H]([C@H](C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)C)OCCCBr)O

InChI

InChI=1S/C21H24BrNO3/c1-14-8-10-16(11-9-14)21(25)23-15(2)19(24)20(26-13-5-12-22)17-6-3-4-7-18(17)23/h3-4,6-11,15,19-20,24H,5,12-13H2,1-2H3/t15-,19-,20-/m0/s1