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

Systemtic Name: methyl 2-[4-[[2-(ethylamino)-2-oxidanylidene-ethyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[[2-(ethylamino)-2-oxo-ethyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[[2-(ethylamino)-2-oxoethyl]amino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-(ethylamino)-2-oxoethyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[[2-(ethylamino)-2-keto-ethyl]carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CCNC(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C18H25N3O6S/c1-3-19-16(22)12-20-17(23)13-8-10-21(11-9-13)28(25,26)15-7-5-4-6-14(15)18(24)27-2/h4-7,13H,3,8-12H2,1-2H3,(H,19,22)(H,20,23)