1,3-benzoxazol-3-ium; (2E)-2-(iodanylmethylidene)-3-methyl-5-phenyl-1,3-thiazolidine

Systemtic Name: 1,3-benzoxazol-3-ium; (2E)-2-(iodanylmethylidene)-3-methyl-5-phenyl-1,3-thiazolidine Openeye Name: 1,3-benzoxazol-3-ium; (2E)-2-(iodomethylene)-3-methyl-5-phenyl-thiazolidine CAS Name: 1,3-benzoxazol-3-ium; (2E)-2-(iodomethylidene)-3-methyl-5-phenylthiazolidine IUPAC Name: 1,3-benzoxazol-3-ium; (2E)-2-(iodomethylidene)-3-methyl-5-phenyl-1,3-thiazolidine Traditional Name: 1,3-benzoxazol-3-ium; (2E)-2-(iodomethylene)-3-methyl-5-phenyl-thiazolidine Formula: C18H18IN2OS+ MolecularWeight: 437.31779

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(SC1=CI)C2=CC=CC=C2.C1=CC=C2C(=C1)[NH+]=CO2

Isomeric SMILES

CN\1CC(S/C1=C/I)C2=CC=CC=C2.C1=CC=C2C(=C1)[NH+]=CO2

InChI

InChI=1S/C11H12INS.C7H5NO/c1-13-8-10(14-11(13)7-12)9-5-3-2-4-6-9;1-2-4-7-6(3-1)8-5-9-7/h2-7,10H,8H2,1H3;1-5H/p+1/b11-7+;