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

Systemtic Name: phenyl [(5-methyl-3-oxidanylidene-1-phenyl-2-propyl-hexyl)amino]-oxidanylidene-methanesulfonate Openeye Name: phenyl [(5-methyl-3-oxo-1-phenyl-2-propyl-hexyl)amino]-oxo-methanesulfonate CAS Name: [(5-methyl-3-oxo-1-phenyl-2-propylhexyl)amino]-oxomethanesulfonic acid phenyl ester IUPAC Name: phenyl [(5-methyl-3-oxo-1-phenyl-2-propylhexyl)amino]-oxomethanesulfonate Traditional Name: keto-[(3-keto-5-methyl-1-phenyl-2-propyl-hexyl)amino]methanesulfonic acid phenyl ester Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO5S/c1-4-11-20(21(25)16-17(2)3)22(18-12-7-5-8-13-18)24-23(26)30(27,28)29-19-14-9-6-10-15-19/h5-10,12-15,17,20,22H,4,11,16H2,1-3H3,(H,24,26)