methyl 4-[2-[[1-(4-tert-butylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[1-(4-tert-butylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[1-(4-tert-butylphenyl)sulfonylpiperidine-4-carbonyl]amino]ethyl]benzoate CAS Name: 4-[2-[[[1-(4-tert-butylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[1-(4-tert-butylphenyl)sulfonylpiperidine-4-carbonyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[1-(4-tert-butylphenyl)sulfonylisonipecotoyl]amino]ethyl]benzoic acid methyl ester Formula: C26H34N2O5S MolecularWeight: 486.62356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C26H34N2O5S/c1-26(2,3)22-9-11-23(12-10-22)34(31,32)28-17-14-20(15-18-28)24(29)27-16-13-19-5-7-21(8-6-19)25(30)33-4/h5-12,20H,13-18H2,1-4H3,(H,27,29)