ethyl 4-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-4-oxo-butanoate CAS Name: 4-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(4-methoxy-3-piperidinosulfonyl-anilino)butyric acid ethyl ester Formula: C18H26N2O6S MolecularWeight: 398.47384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C18H26N2O6S/c1-3-26-18(22)10-9-17(21)19-14-7-8-15(25-2)16(13-14)27(23,24)20-11-5-4-6-12-20/h7-8,13H,3-6,9-12H2,1-2H3,(H,19,21)