methyl 1-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]cycloheptane-1-carboxylate

Systemtic Name: methyl 1-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]cycloheptane-1-carboxylate Openeye Name: methyl 1-[(4-morpholinosulfonylphenyl)sulfonylamino]cycloheptanecarboxylate CAS Name: 1-[[4-(4-morpholinylsulfonyl)phenyl]sulfonylamino]-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]cycloheptane-1-carboxylate Traditional Name: 1-[(4-morpholinosulfonylphenyl)sulfonylamino]cycloheptanecarboxylic acid methyl ester Formula: C19H28N2O7S2 MolecularWeight: 460.56482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCCC1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1(CCCCCC1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H28N2O7S2/c1-27-18(22)19(10-4-2-3-5-11-19)20-29(23,24)16-6-8-17(9-7-16)30(25,26)21-12-14-28-15-13-21/h6-9,20H,2-5,10-15H2,1H3