(2S)-2-(1,3-benzodioxol-5-yloxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Openeye Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one CAS Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-butanone IUPAC Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Traditional Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-1-(3,4-dihydro-2H-quinolin-1-yl)butan-1-one Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCC2=CC=CC=C21)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC[C@@H](C(=O)N1CCCC2=CC=CC=C21)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21NO4/c1-2-17(25-15-9-10-18-19(12-15)24-13-23-18)20(22)21-11-5-7-14-6-3-4-8-16(14)21/h3-4,6,8-10,12,17H,2,5,7,11,13H2,1H3/t17-/m0/s1