[6,7,8-tris(chloranylsulfonyl)pyren-1-yl] ethanoate

Systemtic Name: [6,7,8-tris(chloranylsulfonyl)pyren-1-yl] ethanoate Openeye Name: [6,7,8-tris(chlorosulfonyl)pyren-1-yl] acetate CAS Name: acetic acid [6,7,8-tris(chlorosulfonyl)-1-pyrenyl] ester IUPAC Name: [6,7,8-tris(chlorosulfonyl)pyren-1-yl] acetate Traditional Name: acetic acid [6,7,8-tris(chlorosulfonyl)pyren-1-yl] ester Formula: C18H9Cl3O8S3 MolecularWeight: 555.81326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C2C=CC3=C(C(=C(C4=C3C2=C(C=C4)C=C1)S(=O)(=O)Cl)S(=O)(=O)Cl)S(=O)(=O)Cl

Isomeric SMILES

CC(=O)OC1=C2C=CC3=C(C(=C(C4=C3C2=C(C=C4)C=C1)S(=O)(=O)Cl)S(=O)(=O)Cl)S(=O)(=O)Cl

InChI

InChI=1S/C18H9Cl3O8S3/c1-8(22)29-13-7-3-9-2-4-11-15-12(6-5-10(13)14(9)15)17(31(20,25)26)18(32(21,27)28)16(11)30(19,23)24/h2-7H,1H3