ethyl 4-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]anilino]-4-oxo-butanoate CAS Name: 4-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]anilino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3,5-dimethylpiperidin-1-yl)sulfonylanilino]-4-oxobutanoate Traditional Name: 4-[4-(3,5-dimethylpiperidino)sulfonylanilino]-4-keto-butyric acid ethyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CC(CC(C2)C)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CC(CC(C2)C)C

InChI

InChI=1S/C19H28N2O5S/c1-4-26-19(23)10-9-18(22)20-16-5-7-17(8-6-16)27(24,25)21-12-14(2)11-15(3)13-21/h5-8,14-15H,4,9-13H2,1-3H3,(H,20,22)