2-[4-[2,2-bis(chloranyl)-1-methyl-cyclopropyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2,2-bis(chloranyl)-1-methyl-cyclopropyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2,2-dichloro-1-methyl-cyclopropanecarbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(2,2-dichloro-1-methylcyclopropyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2,2-dichloro-1-methylcyclopropanecarbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2,2-dichloro-1-methyl-cyclopropanecarbonyl)piperazino]sulfonylbenzonitrile Formula: C16H17Cl2N3O3S MolecularWeight: 402.29548

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1(Cl)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC1(CC1(Cl)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C16H17Cl2N3O3S/c1-15(11-16(15,17)18)14(22)20-6-8-21(9-7-20)25(23,24)13-5-3-2-4-12(13)10-19/h2-5H,6-9,11H2,1H3