6-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]pyridine-3-carboxamide

Systemtic Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]pyridine-3-carboxamide Openeye Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]pyridine-3-carboxamide CAS Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]-3-pyridinecarboxamide IUPAC Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]pyridine-3-carboxamide Traditional Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]nicotinamide Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)OC4=NC=C(C=C4)C(=O)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)OC4=NC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H21N3O2/c23-22(26)18-7-10-21(24-13-18)27-20-8-5-16(6-9-20)14-25-12-11-17-3-1-2-4-19(17)15-25/h1-10,13H,11-12,14-15H2,(H2,23,26)