phenyl [[5-methyl-2-(2-methylpropyl)-3-oxidanylidene-1-phenyl-hexyl]amino]-oxidanylidene-methanesulfonate

Systemtic Name: phenyl [[5-methyl-2-(2-methylpropyl)-3-oxidanylidene-1-phenyl-hexyl]amino]-oxidanylidene-methanesulfonate Openeye Name: phenyl [(2-isobutyl-5-methyl-3-oxo-1-phenyl-hexyl)amino]-oxo-methanesulfonate CAS Name: [[5-methyl-2-(2-methylpropyl)-3-oxo-1-phenylhexyl]amino]-oxomethanesulfonic acid phenyl ester IUPAC Name: phenyl [[5-methyl-2-(2-methylpropyl)-3-oxo-1-phenylhexyl]amino]-oxomethanesulfonate Traditional Name: [(2-isobutyl-3-keto-5-methyl-1-phenyl-hexyl)amino]-keto-methanesulfonic acid phenyl ester Formula: C24H31NO5S MolecularWeight: 445.57164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C1=CC=CC=C1)NC(=O)S(=O)(=O)OC2=CC=CC=C2)C(=O)CC(C)C

Isomeric SMILES

CC(C)CC(C(C1=CC=CC=C1)NC(=O)S(=O)(=O)OC2=CC=CC=C2)C(=O)CC(C)C

InChI

InChI=1S/C24H31NO5S/c1-17(2)15-21(22(26)16-18(3)4)23(19-11-7-5-8-12-19)25-24(27)31(28,29)30-20-13-9-6-10-14-20/h5-14,17-18,21,23H,15-16H2,1-4H3,(H,25,27)