1-[4,4-dimethyl-1,3-bis(oxidanylidene)isoquinolin-7-yl]urea

Systemtic Name: 1-[4,4-dimethyl-1,3-bis(oxidanylidene)isoquinolin-7-yl]urea Openeye Name: (4,4-dimethyl-1,3-dioxo-7-isoquinolyl)urea CAS Name: (4,4-dimethyl-1,3-dioxo-7-isoquinolinyl)urea IUPAC Name: (4,4-dimethyl-1,3-dioxoisoquinolin-7-yl)urea Traditional Name: (1,3-diketo-4,4-dimethyl-7-isoquinolyl)urea Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)NC(=O)N)C(=O)NC1=O)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)NC(=O)N)C(=O)NC1=O)C

InChI

InChI=1S/C12H13N3O3/c1-12(2)8-4-3-6(14-11(13)18)5-7(8)9(16)15-10(12)17/h3-5H,1-2H3,(H3,13,14,18)(H,15,16,17)