methyl 2-[[1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carbonyl]amino]acetate CAS Name: 2-[[oxo-[1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carbonyl]amino]acetate Traditional Name: 2-[[1-(2,3,5,6-tetramethylphenyl)sulfonylisonipecotoyl]amino]acetic acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)OC)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)OC)C)C

InChI

InChI=1S/C19H28N2O5S/c1-12-10-13(2)15(4)18(14(12)3)27(24,25)21-8-6-16(7-9-21)19(23)20-11-17(22)26-5/h10,16H,6-9,11H2,1-5H3,(H,20,23)