cyclohexylmethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: cyclohexylmethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: cyclohexylmethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid cyclohexylmethyl ester Formula: C20H28N2O5S MolecularWeight: 408.51172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3CCCCC3

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3CCCCC3

InChI

InChI=1S/C20H28N2O5S/c1-16(23)21-11-13-22(14-12-21)28(25,26)19-9-7-18(8-10-19)20(24)27-15-17-5-3-2-4-6-17/h7-10,17H,2-6,11-15H2,1H3