methyl 3-[cyclohexyl-(4-piperidin-1-ylsulfonylphenyl)sulfonyl-amino]propanoate

Systemtic Name: methyl 3-[cyclohexyl-(4-piperidin-1-ylsulfonylphenyl)sulfonyl-amino]propanoate Openeye Name: methyl 3-[cyclohexyl-[4-(1-piperidylsulfonyl)phenyl]sulfonyl-amino]propanoate CAS Name: 3-[cyclohexyl-[4-(1-piperidinylsulfonyl)phenyl]sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[cyclohexyl-(4-piperidin-1-ylsulfonylphenyl)sulfonylamino]propanoate Traditional Name: 3-[cyclohexyl-(4-piperidinosulfonylphenyl)sulfonyl-amino]propionic acid methyl ester Formula: C21H32N2O6S2 MolecularWeight: 472.61858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)CCN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H32N2O6S2/c1-29-21(24)14-17-23(18-8-4-2-5-9-18)31(27,28)20-12-10-19(11-13-20)30(25,26)22-15-6-3-7-16-22/h10-13,18H,2-9,14-17H2,1H3