5,7-bis(2-methylbutan-2-yl)-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one

Systemtic Name: 5,7-bis(2-methylbutan-2-yl)-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one Openeye Name: 5,7-bis(1,1-dimethylpropyl)-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one CAS Name: 5,7-bis(2-methylbutan-2-yl)-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one IUPAC Name: 5,7-bis(2-methylbutan-2-yl)-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one Traditional Name: 5,7-ditert-amyl-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one Formula: C23H29N2O2+ MolecularWeight: 365.48856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C2C(=C1)N=[N+](C(=O)O2)C3=CC=CC=C3)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C2C(=C1)N=[N+](C(=O)O2)C3=CC=CC=C3)C(C)(C)CC

InChI

InChI=1S/C23H29N2O2/c1-7-22(3,4)16-14-18(23(5,6)8-2)20-19(15-16)24-25(21(26)27-20)17-12-10-9-11-13-17/h9-15H,7-8H2,1-6H3/q+1