ethyl 4-[4-(phenethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=C3

InChI

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