methyl 2-[4-(2-phenylpropylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(2-phenylpropylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(2-phenylpropylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-(2-phenylpropylamino)methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(2-phenylpropylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(2-phenylpropylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O5S/c1-17(18-8-4-3-5-9-18)16-24-22(26)19-12-14-25(15-13-19)31(28,29)21-11-7-6-10-20(21)23(27)30-2/h3-11,17,19H,12-16H2,1-2H3,(H,24,26)