ethyl 4-[4-[1-(5-methylfuran-2-yl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[1-(5-methylfuran-2-yl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[1-(5-methyl-2-furyl)ethylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[[1-(5-methyl-2-furanyl)ethylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[1-(5-methylfuran-2-yl)ethylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[1-(5-methyl-2-furyl)ethylcarbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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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)C3=CC=C(O3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=C(O3)C

InChI

InChI=1S/C22H28N2O6S/c1-4-29-22(26)18-6-8-19(9-7-18)31(27,28)24-13-11-17(12-14-24)21(25)23-16(3)20-10-5-15(2)30-20/h5-10,16-17H,4,11-14H2,1-3H3,(H,23,25)