5-[bis(4-chlorophenyl)methylsulfonyl]pent-3-yn-2-one

Systemtic Name: 5-[bis(4-chlorophenyl)methylsulfonyl]pent-3-yn-2-one Openeye Name: 5-[bis(4-chlorophenyl)methylsulfonyl]pent-3-yn-2-one CAS Name: 5-[bis(4-chlorophenyl)methylsulfonyl]-3-pentyn-2-one IUPAC Name: 5-[bis(4-chlorophenyl)methylsulfonyl]pent-3-yn-2-one Traditional Name: 5-[bis(4-chlorophenyl)methylsulfonyl]pent-3-yn-2-one Formula: C18H14Cl2O3S MolecularWeight: 381.27296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C#CCS(=O)(=O)C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)C#CCS(=O)(=O)C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H14Cl2O3S/c1-13(21)3-2-12-24(22,23)18(14-4-8-16(19)9-5-14)15-6-10-17(20)11-7-15/h4-11,18H,12H2,1H3