cyclobutyl-[(3S,4S)-3-[isoquinolin-5-ylmethyl(methyl)amino]-4-oxidanyl-pyrrolidin-1-yl]methanone

Systemtic Name: cyclobutyl-[(3S,4S)-3-[isoquinolin-5-ylmethyl(methyl)amino]-4-oxidanyl-pyrrolidin-1-yl]methanone Openeye Name: cyclobutyl-[(3S,4S)-3-hydroxy-4-[5-isoquinolylmethyl(methyl)amino]pyrrolidin-1-yl]methanone CAS Name: cyclobutyl-[(3S,4S)-3-hydroxy-4-[5-isoquinolinylmethyl(methyl)amino]-1-pyrrolidinyl]methanone IUPAC Name: cyclobutyl-[(3S,4S)-3-hydroxy-4-[isoquinolin-5-ylmethyl(methyl)amino]pyrrolidin-1-yl]methanone Traditional Name: cyclobutyl-[(3S,4S)-3-hydroxy-4-[5-isoquinolylmethyl(methyl)amino]pyrrolidino]methanone Formula: C20H25N3O2 MolecularWeight: 339.4314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC2=C1C=CN=C2)C3CN(CC3O)C(=O)C4CCC4

Isomeric SMILES

CN(CC1=CC=CC2=C1C=CN=C2)[C@H]3CN(C[C@@H]3O)C(=O)C4CCC4

InChI

InChI=1S/C20H25N3O2/c1-22(11-16-7-3-6-15-10-21-9-8-17(15)16)18-12-23(13-19(18)24)20(25)14-4-2-5-14/h3,6-10,14,18-19,24H,2,4-5,11-13H2,1H3/t18-,19-/m0/s1