methyl 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]heptanoate

Systemtic Name: methyl 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]heptanoate Openeye Name: methyl 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]heptanoate CAS Name: 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-1-oxopropyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxypropanoyl]amino]heptanoate Traditional Name: 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-methylsulfonyloxy-propanoyl]amino]enanthic acid methyl ester Formula: C18H27ClN2O8S2 MolecularWeight: 498.99858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C(COS(=O)(=O)C)NS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C(COS(=O)(=O)C)NS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C18H27ClN2O8S2/c1-28-17(22)7-5-3-4-6-12-20-18(23)16(13-29-30(2,24)25)21-31(26,27)15-10-8-14(19)9-11-15/h8-11,16,21H,3-7,12-13H2,1-2H3,(H,20,23)