ethyl 2-methyl-3-[[1-[(4-methylphenyl)methylsulfonyl]piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 2-methyl-3-[[1-[(4-methylphenyl)methylsulfonyl]piperidin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 2-methyl-3-[[1-(p-tolylmethylsulfonyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 2-methyl-3-[[[1-[(4-methylphenyl)methylsulfonyl]-4-piperidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-[[1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carbonyl]amino]benzoate Traditional Name: 2-methyl-3-[[1-(4-methylbenzyl)sulfonylisonipecotoyl]amino]benzoic acid ethyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)C)C

InChI

InChI=1S/C24H30N2O5S/c1-4-31-24(28)21-6-5-7-22(18(21)3)25-23(27)20-12-14-26(15-13-20)32(29,30)16-19-10-8-17(2)9-11-19/h5-11,20H,4,12-16H2,1-3H3,(H,25,27)