(3S,4S)-4-[[azanyl(methyl)amino]methyl]-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: (3S,4S)-4-[[azanyl(methyl)amino]methyl]-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one Openeye Name: (3S,4S)-4-[[amino(methyl)amino]methyl]-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one CAS Name: (3S,4S)-4-[[amino(methyl)amino]methyl]-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one IUPAC Name: (3S,4S)-4-[[amino(methyl)amino]methyl]-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one Traditional Name: (3S,4S)-4-[[amino(methyl)amino]methyl]-2-ethyl-3-propyl-3,4-dihydroisocarbostyril Formula: C16H25N3O MolecularWeight: 275.3892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C2=CC=CC=C2C(=O)N1CC)CN(C)N

Isomeric SMILES

CCC[C@H]1[C@@H](C2=CC=CC=C2C(=O)N1CC)CN(C)N

InChI

InChI=1S/C16H25N3O/c1-4-8-15-14(11-18(3)17)12-9-6-7-10-13(12)16(20)19(15)5-2/h6-7,9-10,14-15H,4-5,8,11,17H2,1-3H3/t14-,15+/m1/s1