methyl 1-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]cycloheptane-1-carboxylate

Systemtic Name: methyl 1-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]cycloheptane-1-carboxylate Openeye Name: methyl 1-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]cycloheptanecarboxylate CAS Name: 1-[(5-acetamido-2-methoxyphenyl)sulfonylamino]-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(5-acetamido-2-methoxyphenyl)sulfonylamino]cycloheptane-1-carboxylate Traditional Name: 1-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]cycloheptanecarboxylic acid methyl ester Formula: C18H26N2O6S MolecularWeight: 398.47384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)NC2(CCCCCC2)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)NC2(CCCCCC2)C(=O)OC

InChI

InChI=1S/C18H26N2O6S/c1-13(21)19-14-8-9-15(25-2)16(12-14)27(23,24)20-18(17(22)26-3)10-6-4-5-7-11-18/h8-9,12,20H,4-7,10-11H2,1-3H3,(H,19,21)