ethyl 4-[4-[1-(oxolan-2-yl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[1-(oxolan-2-yl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-(1-tetrahydrofuran-2-ylethylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[oxo-[1-(2-oxolanyl)ethylamino]methyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[1-(oxolan-2-yl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[1-(tetrahydrofuryl)ethylcarbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3CCCO3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3CCCO3

InChI

InChI=1S/C21H30N2O6S/c1-3-28-21(25)17-6-8-18(9-7-17)30(26,27)23-12-10-16(11-13-23)20(24)22-15(2)19-5-4-14-29-19/h6-9,15-16,19H,3-5,10-14H2,1-2H3,(H,22,24)