1-butyl-3-(6,7-dimethoxy-1-methyl-3-oxidanylidene-2H-isoquinolin-4-yl)urea

Systemtic Name: 1-butyl-3-(6,7-dimethoxy-1-methyl-3-oxidanylidene-2H-isoquinolin-4-yl)urea Openeye Name: 1-butyl-3-(6,7-dimethoxy-1-methyl-3-oxo-2H-isoquinolin-4-yl)urea CAS Name: 1-butyl-3-(6,7-dimethoxy-1-methyl-3-oxo-2H-isoquinolin-4-yl)urea IUPAC Name: 1-butyl-3-(6,7-dimethoxy-1-methyl-3-oxo-2H-isoquinolin-4-yl)urea Traditional Name: 1-butyl-3-(3-keto-6,7-dimethoxy-1-methyl-2H-isoquinolin-4-yl)urea Formula: C17H23N3O4 MolecularWeight: 333.38222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C2C=C(C(=CC2=C(NC1=O)C)OC)OC

Isomeric SMILES

CCCCNC(=O)NC1=C2C=C(C(=CC2=C(NC1=O)C)OC)OC

InChI

InChI=1S/C17H23N3O4/c1-5-6-7-18-17(22)20-15-12-9-14(24-4)13(23-3)8-11(12)10(2)19-16(15)21/h8-9H,5-7H2,1-4H3,(H,19,21)(H2,18,20,22)