calcium butoxy-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]phosphinate

Systemtic Name: calcium butoxy-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]phosphinate Openeye Name: calcium butoxy-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]phosphinate CAS Name: calcium butoxy-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]phosphinate IUPAC Name: calcium butoxy-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]phosphinate Traditional Name: calcium butoxy-(3,5-ditert-butyl-4-hydroxy-benzyl)phosphinate Formula: C38H64CaO8P2 MolecularWeight: 750.935482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].CCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].[Ca+2]

Isomeric SMILES

CCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].CCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].[Ca+2]

InChI

InChI=1S/2C19H33O4P.Ca/c2*1-8-9-10-23-24(21,22)13-14-11-15(18(2,3)4)17(20)16(12-14)19(5,6)7;/h2*11-12,20H,8-10,13H2,1-7H3,(H,21,22);/q;;+2/p-2