7-azanyl-8-bromanyl-4,4-dimethyl-6-nitro-isoquinoline-1,3-dione

Systemtic Name: 7-azanyl-8-bromanyl-4,4-dimethyl-6-nitro-isoquinoline-1,3-dione Openeye Name: 7-amino-8-bromo-4,4-dimethyl-6-nitro-isoquinoline-1,3-dione CAS Name: 7-amino-8-bromo-4,4-dimethyl-6-nitroisoquinoline-1,3-dione IUPAC Name: 7-amino-8-bromo-4,4-dimethyl-6-nitroisoquinoline-1,3-dione Traditional Name: 7-amino-8-bromo-4,4-dimethyl-6-nitro-isoquinoline-1,3-quinone Formula: C11H10BrN3O4 MolecularWeight: 328.1188

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=C(C(=C2C(=O)NC1=O)Br)N)[N+](=O)[O-])C

Isomeric SMILES

CC1(C2=CC(=C(C(=C2C(=O)NC1=O)Br)N)[N+](=O)[O-])C

InChI

InChI=1S/C11H10BrN3O4/c1-11(2)4-3-5(15(18)19)8(13)7(12)6(4)9(16)14-10(11)17/h3H,13H2,1-2H3,(H,14,16,17)