1-[2-[(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(2-isopropoxy-5-morpholinosulfonyl-anilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyanilino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyanilino)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(2-isopropoxy-5-morpholinosulfonyl-anilino)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C21H33N4O6S+ MolecularWeight: 469.57492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H32N4O6S/c1-15(2)31-19-4-3-17(32(28,29)25-9-11-30-12-10-25)13-18(19)23-20(26)14-24-7-5-16(6-8-24)21(22)27/h3-4,13,15-16H,5-12,14H2,1-2H3,(H2,22,27)(H,23,26)/p+1