ethyl 4-[(4-methoxy-3-methylsulfonyloxy-phenyl)methyl-(2-methylpropyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(4-methoxy-3-methylsulfonyloxy-phenyl)methyl-(2-methylpropyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[isobutyl-[(4-methoxy-3-methylsulfonyloxy-phenyl)methyl]amino]-4-oxo-butanoate CAS Name: 4-[(4-methoxy-3-methylsulfonyloxyphenyl)methyl-(2-methylpropyl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxy-3-methylsulfonyloxyphenyl)methyl-(2-methylpropyl)amino]-4-oxobutanoate Traditional Name: 4-[isobutyl-(4-methoxy-3-methylsulfonyloxy-benzyl)amino]-4-keto-butyric acid ethyl ester Formula: C19H29NO7S MolecularWeight: 415.50106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)CC(C)C

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)CC(C)C

InChI

InChI=1S/C19H29NO7S/c1-6-26-19(22)10-9-18(21)20(12-14(2)3)13-15-7-8-16(25-4)17(11-15)27-28(5,23)24/h7-8,11,14H,6,9-10,12-13H2,1-5H3