1-(cyclohexylmethyl)-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine

Systemtic Name: 1-(cyclohexylmethyl)-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine Openeye Name: 1-(cyclohexylmethyl)-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine CAS Name: 1-(cyclohexylmethyl)-4-(4-methoxy-3-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-(cyclohexylmethyl)-4-(4-methoxy-3-nitrophenyl)sulfonylpiperazine Traditional Name: 1-(cyclohexylmethyl)-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O5S/c1-26-18-8-7-16(13-17(18)21(22)23)27(24,25)20-11-9-19(10-12-20)14-15-5-3-2-4-6-15/h7-8,13,15H,2-6,9-12,14H2,1H3