[(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [(3S)-6-chlorochroman-3-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [(3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [(3S)-6-chloro-3,4-dihydro-2H-chromen-3-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [(3S)-6-chlorochroman-3-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C23H26ClNO4 MolecularWeight: 415.90984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3CC4=C(C=CC(=C4)Cl)OC3)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)[C@H]3CC4=C(C=CC(=C4)Cl)OC3)OCC

InChI

InChI=1S/C23H26ClNO4/c1-3-27-21-11-15-7-8-25(13-17(15)12-22(21)28-4-2)23(26)18-9-16-10-19(24)5-6-20(16)29-14-18/h5-6,10-12,18H,3-4,7-9,13-14H2,1-2H3/t18-/m0/s1