2-(4-bromanylbutyl)-5,6,7-trimethoxy-phthalazin-1-one

Systemtic Name: 2-(4-bromanylbutyl)-5,6,7-trimethoxy-phthalazin-1-one Openeye Name: 2-(4-bromobutyl)-5,6,7-trimethoxy-phthalazin-1-one CAS Name: 2-(4-bromobutyl)-5,6,7-trimethoxy-1-phthalazinone IUPAC Name: 2-(4-bromobutyl)-5,6,7-trimethoxyphthalazin-1-one Traditional Name: 2-(4-bromobutyl)-5,6,7-trimethoxy-phthalazin-1-one Formula: C15H19BrN2O4 MolecularWeight: 371.22636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C=NN(C(=O)C2=C1)CCCCBr)OC)OC

Isomeric SMILES

COC1=C(C(=C2C=NN(C(=O)C2=C1)CCCCBr)OC)OC

InChI

InChI=1S/C15H19BrN2O4/c1-20-12-8-10-11(13(21-2)14(12)22-3)9-17-18(15(10)19)7-5-4-6-16/h8-9H,4-7H2,1-3H3