N-[(7-methoxy-6-methyl-5-phenylmethoxy-isoquinolin-1-yl)methyl]-2-oxidanylidene-propanamide

Systemtic Name: N-[(7-methoxy-6-methyl-5-phenylmethoxy-isoquinolin-1-yl)methyl]-2-oxidanylidene-propanamide Openeye Name: N-[(5-benzyloxy-7-methoxy-6-methyl-1-isoquinolyl)methyl]-2-oxo-propanamide CAS Name: N-[(7-methoxy-6-methyl-5-phenylmethoxy-1-isoquinolinyl)methyl]-2-oxopropanamide IUPAC Name: N-[(7-methoxy-6-methyl-5-phenylmethoxyisoquinolin-1-yl)methyl]-2-oxopropanamide Traditional Name: N-[(5-benzoxy-7-methoxy-6-methyl-1-isoquinolyl)methyl]-2-keto-propionamide Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1OCC3=CC=CC=C3)C=CN=C2CNC(=O)C(=O)C)OC

Isomeric SMILES

CC1=C(C=C2C(=C1OCC3=CC=CC=C3)C=CN=C2CNC(=O)C(=O)C)OC

InChI

InChI=1S/C22H22N2O4/c1-14-20(27-3)11-18-17(21(14)28-13-16-7-5-4-6-8-16)9-10-23-19(18)12-24-22(26)15(2)25/h4-11H,12-13H2,1-3H3,(H,24,26)