[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(2-nitrocyclopropyl)methanone

Systemtic Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(2-nitrocyclopropyl)methanone Openeye Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(2-nitrocyclopropyl)methanone CAS Name: [4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-(2-nitrocyclopropyl)methanone IUPAC Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(2-nitrocyclopropyl)methanone Traditional Name: [4-(4-tert-butylphenyl)sulfonylpiperazino]-(2-nitrocyclopropyl)methanone Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CC3[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CC3[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O5S/c1-18(2,3)13-4-6-14(7-5-13)27(25,26)20-10-8-19(9-11-20)17(22)15-12-16(15)21(23)24/h4-7,15-16H,8-12H2,1-3H3