methyl 2-[4-[1-(4-tert-butylphenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[1-(4-tert-butylphenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[1-(4-tert-butylphenyl)ethylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[1-(4-tert-butylphenyl)ethylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[1-(4-tert-butylphenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[1-(4-tert-butylphenyl)ethylcarbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C26H34N2O5S MolecularWeight: 486.62356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C26H34N2O5S/c1-18(19-10-12-21(13-11-19)26(2,3)4)27-24(29)20-14-16-28(17-15-20)34(31,32)23-9-7-6-8-22(23)25(30)33-5/h6-13,18,20H,14-17H2,1-5H3,(H,27,29)