methyl 2-[4-(3-methylbutan-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(3-methylbutan-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(1,2-dimethylpropylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[(3-methylbutan-2-ylamino)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(3-methylbutan-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(1,2-dimethylpropylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC(C)C(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C19H28N2O5S/c1-13(2)14(3)20-18(22)15-9-11-21(12-10-15)27(24,25)17-8-6-5-7-16(17)19(23)26-4/h5-8,13-15H,9-12H2,1-4H3,(H,20,22)