methyl 4-[4-[[4-(tert-butylsulfonylamino)cyclohexyl]carbonylamino]phenyl]butanoate

Systemtic Name: methyl 4-[4-[[4-(tert-butylsulfonylamino)cyclohexyl]carbonylamino]phenyl]butanoate Openeye Name: methyl 4-[4-[[4-(tert-butylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butanoate CAS Name: 4-[4-[[[4-(tert-butylsulfonylamino)cyclohexyl]-oxomethyl]amino]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[[4-(tert-butylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butanoate Traditional Name: 4-[4-[[4-(tert-butylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butyric acid methyl ester Formula: C22H34N2O5S MolecularWeight: 438.58076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)CCCC(=O)OC

Isomeric SMILES

CC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)CCCC(=O)OC

InChI

InChI=1S/C22H34N2O5S/c1-22(2,3)30(27,28)24-19-14-10-17(11-15-19)21(26)23-18-12-8-16(9-13-18)6-5-7-20(25)29-4/h8-9,12-13,17,19,24H,5-7,10-11,14-15H2,1-4H3,(H,23,26)