3-(4-chlorophenyl)-2,2-diethanoyl-1-(phenylsulfonyl)cyclopropane-1-carbonitrile

Systemtic Name: 3-(4-chlorophenyl)-2,2-diethanoyl-1-(phenylsulfonyl)cyclopropane-1-carbonitrile Openeye Name: 2,2-diacetyl-1-(benzenesulfonyl)-3-(4-chlorophenyl)cyclopropanecarbonitrile CAS Name: 2,2-diacetyl-1-(benzenesulfonyl)-3-(4-chlorophenyl)-1-cyclopropanecarbonitrile IUPAC Name: 2,2-diacetyl-1-(benzenesulfonyl)-3-(4-chlorophenyl)cyclopropane-1-carbonitrile Traditional Name: 2,2-diacetyl-1-besyl-3-(4-chlorophenyl)cyclopropanecarbonitrile Formula: C20H16ClNO4S MolecularWeight: 401.86334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C(C1(C#N)S(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)C

Isomeric SMILES

CC(=O)C1(C(C1(C#N)S(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)C

InChI

InChI=1S/C20H16ClNO4S/c1-13(23)20(14(2)24)18(15-8-10-16(21)11-9-15)19(20,12-22)27(25,26)17-6-4-3-5-7-17/h3-11,18H,1-2H3