methyl 2-[(2R)-1-(4-cyclohexylphenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-1-(4-cyclohexylphenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[(2R)-1-(4-cyclohexylphenyl)sulfonyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2R)-1-(4-cyclohexylphenyl)sulfonyl-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-(4-cyclohexylphenyl)sulfonyl-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2R)-1-(4-cyclohexylphenyl)sulfonyl-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C19H26N2O5S/c1-26-18(22)13-17-19(23)20-11-12-21(17)27(24,25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h7-10,14,17H,2-6,11-13H2,1H3,(H,20,23)/t17-/m1/s1