(7-methoxy-6-methyl-5-oxidanyl-isoquinolin-1-yl)methyl (Z)-2-methylbut-2-enoate

Systemtic Name: (7-methoxy-6-methyl-5-oxidanyl-isoquinolin-1-yl)methyl (Z)-2-methylbut-2-enoate Openeye Name: (5-hydroxy-7-methoxy-6-methyl-1-isoquinolyl)methyl (Z)-2-methylbut-2-enoate CAS Name: (Z)-2-methyl-2-butenoic acid (5-hydroxy-7-methoxy-6-methyl-1-isoquinolinyl)methyl ester IUPAC Name: (5-hydroxy-7-methoxy-6-methylisoquinolin-1-yl)methyl (Z)-2-methylbut-2-enoate Traditional Name: (Z)-2-methylbut-2-enoic acid (5-hydroxy-7-methoxy-6-methyl-1-isoquinolyl)methyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)OCC1=NC=CC2=C(C(=C(C=C21)OC)C)O

Isomeric SMILES

C/C=C(/C)\C(=O)OCC1=NC=CC2=C(C(=C(C=C21)OC)C)O

InChI

InChI=1S/C17H19NO4/c1-5-10(2)17(20)22-9-14-13-8-15(21-4)11(3)16(19)12(13)6-7-18-14/h5-8,19H,9H2,1-4H3/b10-5-