methyl 2-[4-[[(2S)-pentan-2-yl]carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[[(2S)-pentan-2-yl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[[(1S)-1-methylbutyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-[[(2S)-pentan-2-yl]amino]methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[(2S)-pentan-2-yl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[[(1S)-1-methylbutyl]carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@H](C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C19H28N2O5S/c1-4-7-14(2)20-18(22)15-10-12-21(13-11-15)27(24,25)17-9-6-5-8-16(17)19(23)26-3/h5-6,8-9,14-15H,4,7,10-13H2,1-3H3,(H,20,22)/t14-/m0/s1