1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate; N,N-dimethyl-1-phenyl-methanamine; gold(3+)

Systemtic Name: 1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate; N,N-dimethyl-1-phenyl-methanamine; gold(3+) Openeye Name: N,N-dimethyl-1-phenyl-methanamine; 1,1-dioxo-1,2-benzothiazol-3-olate; gold(3+) CAS Name: N,N-dimethyl-1-phenylmethanamine; 1,1-dioxo-1,2-benzothiazol-3-olate; gold(3+) IUPAC Name: N,N-dimethyl-1-phenylmethanamine; 1,1-dioxo-1,2-benzothiazol-3-olate; gold(3+) Traditional Name: benzyl(dimethyl)amine; 1,1-diketo-1,2-benzothiazol-3-olate; gold(3+) Formula: C23H20AuN3O6S2 MolecularWeight: 695.51795

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C[C-]=CC=C1.C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].[Au+3]

Isomeric SMILES

CN(C)CC1=C[C-]=CC=C1.C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].[Au+3]

InChI

InChI=1S/C9H12N.2C7H5NO3S.Au/c1-10(2)8-9-6-4-3-5-7-9;2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h3-4,6-7H,8H2,1-2H3;2*1-4H,(H,8,9);/q-1;;;+3/p-2