4-methyl-1,2,3-benzothiadiazole-5-carboxylate; triphenylstannanylium

Systemtic Name: 4-methyl-1,2,3-benzothiadiazole-5-carboxylate; triphenylstannanylium Openeye Name: 4-methyl-1,2,3-benzothiadiazole-5-carboxylate; triphenylstannanylium CAS Name: 4-methyl-1,2,3-benzothiadiazole-5-carboxylate; triphenylstannanylium IUPAC Name: 4-methyl-1,2,3-benzothiadiazole-5-carboxylate; triphenylstannanylium Traditional Name: 4-methyl-1,2,3-benzothiadiazole-5-carboxylate; triphenylstannanylium Formula: C26H20N2O2SSn MolecularWeight: 543.2242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=NS2)C(=O)[O-].C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC2=C1N=NS2)C(=O)[O-].C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C8H6N2O2S.3C6H5.Sn/c1-4-5(8(11)12)2-3-6-7(4)9-10-13-6;3*1-2-4-6-5-3-1;/h2-3H,1H3,(H,11,12);3*1-5H;/q;;;;+1/p-1