[2-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-ethoxyethanoate

Systemtic Name: [2-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-ethoxyethanoate Openeye Name: [2-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-anilino)-2-oxo-ethyl] 2-ethoxyacetate CAS Name: 2-ethoxyacetic acid [2-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-ethoxy-3-pyrrolidin-1-ylsulfonylanilino)-2-oxoethyl] 2-ethoxyacetate Traditional Name: 2-ethoxyacetic acid [2-(4-ethoxy-3-pyrrolidinosulfonyl-anilino)-2-keto-ethyl] ester Formula: C18H26N2O7S MolecularWeight: 414.47324

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)OCC(=O)NC1=CC(=C(C=C1)OCC)S(=O)(=O)N2CCCC2

Isomeric SMILES

CCOCC(=O)OCC(=O)NC1=CC(=C(C=C1)OCC)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C18H26N2O7S/c1-3-25-13-18(22)27-12-17(21)19-14-7-8-15(26-4-2)16(11-14)28(23,24)20-9-5-6-10-20/h7-8,11H,3-6,9-10,12-13H2,1-2H3,(H,19,21)