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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=CC2=C(C(=O)N1)NC(=O)NC(C)(C)C)OC)OC

Isomeric SMILES

CC1=C2C=C(C(=CC2=C(C(=O)N1)NC(=O)NC(C)(C)C)OC)OC

InChI

InChI=1S/C17H23N3O4/c1-9-10-7-12(23-5)13(24-6)8-11(10)14(15(21)18-9)19-16(22)20-17(2,3)4/h7-8H,1-6H3,(H,18,21)(H2,19,20,22)