N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-3-morpholin-4-yl-propanamide

Systemtic Name: N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-3-morpholin-4-yl-propanamide Openeye Name: N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]methyl]-3-morpholino-propanamide CAS Name: N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinyl]methyl]-3-(4-morpholinyl)propanamide IUPAC Name: N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-3-morpholin-4-ylpropanamide Traditional Name: N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]methyl]-3-morpholino-propionamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=CC=N3)CNC(=O)CCN4CCOCC4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=CC=N3)CNC(=O)CCN4CCOCC4

InChI

InChI=1S/C22H28N4O2/c27-21(8-10-25-12-14-28-15-13-25)24-16-19-6-3-9-23-22(19)26-11-7-18-4-1-2-5-20(18)17-26/h1-6,9H,7-8,10-17H2,(H,24,27)