ethyl 4-[4-[1-(1-benzofuran-2-yl)ethyl-methyl-carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[1-(1-benzofuran-2-yl)ethyl-methyl-carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[1-(benzofuran-2-yl)ethyl-methyl-carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[[1-(2-benzofuranyl)ethyl-methylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[1-(1-benzofuran-2-yl)ethyl-methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[1-(benzofuran-2-yl)ethyl-methyl-carbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C26H30N2O6S MolecularWeight: 498.5912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C(C)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C(C)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C26H30N2O6S/c1-4-33-26(30)20-9-11-22(12-10-20)35(31,32)28-15-13-19(14-16-28)25(29)27(3)18(2)24-17-21-7-5-6-8-23(21)34-24/h5-12,17-19H,4,13-16H2,1-3H3