[2-(3-bromanyl-4,5-dimethoxy-phenyl)-3,4-bis(oxidanylidene)cyclobuten-1-yl]-dimethyl-propyl-azanium

Systemtic Name: [2-(3-bromanyl-4,5-dimethoxy-phenyl)-3,4-bis(oxidanylidene)cyclobuten-1-yl]-dimethyl-propyl-azanium Openeye Name: [2-(3-bromo-4,5-dimethoxy-phenyl)-3,4-dioxo-cyclobuten-1-yl]-dimethyl-propyl-ammonium CAS Name: [2-(3-bromo-4,5-dimethoxyphenyl)-3,4-dioxo-1-cyclobutenyl]-dimethyl-propylammonium IUPAC Name: [2-(3-bromo-4,5-dimethoxyphenyl)-3,4-dioxocyclobuten-1-yl]-dimethyl-propylazanium Traditional Name: [2-(3-bromo-4,5-dimethoxy-phenyl)-3,4-diketo-cyclobuten-1-yl]-dimethyl-propyl-ammonium Formula: C17H21BrNO4+ MolecularWeight: 383.25694

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)C1=C(C(=O)C1=O)C2=CC(=C(C(=C2)Br)OC)OC

Isomeric SMILES

CCC[N+](C)(C)C1=C(C(=O)C1=O)C2=CC(=C(C(=C2)Br)OC)OC

InChI

InChI=1S/C17H21BrNO4/c1-6-7-19(2,3)14-13(15(20)16(14)21)10-8-11(18)17(23-5)12(9-10)22-4/h8-9H,6-7H2,1-5H3/q+1