[(2S,5R)-5-isoquinolin-1-yloxy-2-methyl-piperidin-1-yl]-(2-pyridin-3-ylphenyl)methanone

Systemtic Name: [(2S,5R)-5-isoquinolin-1-yloxy-2-methyl-piperidin-1-yl]-(2-pyridin-3-ylphenyl)methanone Openeye Name: [(2S,5R)-5-(1-isoquinolyloxy)-2-methyl-1-piperidyl]-[2-(3-pyridyl)phenyl]methanone CAS Name: [(2S,5R)-5-(1-isoquinolinyloxy)-2-methyl-1-piperidinyl]-[2-(3-pyridinyl)phenyl]methanone IUPAC Name: [(2S,5R)-5-isoquinolin-1-yloxy-2-methylpiperidin-1-yl]-(2-pyridin-3-ylphenyl)methanone Traditional Name: [(2S,5R)-5-(1-isoquinolyloxy)-2-methyl-piperidino]-[2-(3-pyridyl)phenyl]methanone Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CN1C(=O)C2=CC=CC=C2C3=CN=CC=C3)OC4=NC=CC5=CC=CC=C54

Isomeric SMILES

C[C@H]1CC[C@H](CN1C(=O)C2=CC=CC=C2C3=CN=CC=C3)OC4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C27H25N3O2/c1-19-12-13-22(32-26-24-10-3-2-7-20(24)14-16-29-26)18-30(19)27(31)25-11-5-4-9-23(25)21-8-6-15-28-17-21/h2-11,14-17,19,22H,12-13,18H2,1H3/t19-,22+/m0/s1