1-(cyclohexylmethyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine

Systemtic Name: 1-(cyclohexylmethyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine Openeye Name: 1-(cyclohexylmethyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine CAS Name: 1-(cyclohexylmethyl)-4-(2-methyl-5-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-(cyclohexylmethyl)-4-(2-methyl-5-nitrophenyl)sulfonylpiperazine Traditional Name: 1-(cyclohexylmethyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC3CCCCC3

InChI

InChI=1S/C18H27N3O4S/c1-15-7-8-17(21(22)23)13-18(15)26(24,25)20-11-9-19(10-12-20)14-16-5-3-2-4-6-16/h7-8,13,16H,2-6,9-12,14H2,1H3