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

Systemtic Name: methyl 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-pyridin-3-yloxy-propanoyl]amino]heptanoate Openeye Name: methyl 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-(3-pyridyloxy)propanoyl]amino]heptanoate CAS Name: 7-[[2-[(4-chlorophenyl)sulfonylamino]-1-oxo-3-(3-pyridinyloxy)propyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-pyridin-3-yloxypropanoyl]amino]heptanoate Traditional Name: 7-[[2-[(4-chlorophenyl)sulfonylamino]-3-(3-pyridyloxy)propanoyl]amino]enanthic acid methyl ester Formula: C22H28ClN3O6S MolecularWeight: 497.99222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C(COC1=CN=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C(COC1=CN=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H28ClN3O6S/c1-31-21(27)8-4-2-3-5-14-25-22(28)20(16-32-18-7-6-13-24-15-18)26-33(29,30)19-11-9-17(23)10-12-19/h6-7,9-13,15,20,26H,2-5,8,14,16H2,1H3,(H,25,28)