(2E)-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-4-(3-diethoxyphosphorylpropyl)-1,4-benzothiazin-3-one

Systemtic Name: (2E)-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-4-(3-diethoxyphosphorylpropyl)-1,4-benzothiazin-3-one Openeye Name: (2E)-2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-4-(3-diethoxyphosphorylpropyl)-1,4-benzothiazin-3-one CAS Name: (2E)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-4-(3-diethoxyphosphorylpropyl)-1,4-benzothiazin-3-one IUPAC Name: (2E)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-4-(3-diethoxyphosphorylpropyl)-1,4-benzothiazin-3-one Traditional Name: (2E)-2-(3,5-ditert-butyl-4-hydroxy-benzylidene)-4-(3-diethoxyphosphorylpropyl)-1,4-benzothiazin-3-one Formula: C30H42NO5PS MolecularWeight: 559.696941

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCN1C2=CC=CC=C2SC(=CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C1=O)OCC

Isomeric SMILES

CCOP(=O)(CCCN1C2=CC=CC=C2S/C(=C/C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)/C1=O)OCC

InChI

InChI=1S/C30H42NO5PS/c1-9-35-37(34,36-10-2)17-13-16-31-24-14-11-12-15-25(24)38-26(28(31)33)20-21-18-22(29(3,4)5)27(32)23(19-21)30(6,7)8/h11-12,14-15,18-20,32H,9-10,13,16-17H2,1-8H3/b26-20+