[3,4-bis(2,4-ditert-butylphenyl)-2-methyl-naphthalen-1-yl]phosphonic acid

Systemtic Name: [3,4-bis(2,4-ditert-butylphenyl)-2-methyl-naphthalen-1-yl]phosphonic acid Openeye Name: [3,4-bis(2,4-ditert-butylphenyl)-2-methyl-1-naphthyl]phosphonic acid CAS Name: [3,4-bis(2,4-ditert-butylphenyl)-2-methyl-1-naphthalenyl]phosphonic acid IUPAC Name: [3,4-bis(2,4-ditert-butylphenyl)-2-methylnaphthalen-1-yl]phosphonic acid Traditional Name: [3,4-bis(2,4-ditert-butylphenyl)-2-methyl-1-naphthyl]phosphonic acid Formula: C39H51O3P MolecularWeight: 598.794201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=C1C3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)C4=C(C=C(C=C4)C(C)(C)C)C(C)(C)C)P(=O)(O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=C1C3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)C4=C(C=C(C=C4)C(C)(C)C)C(C)(C)C)P(=O)(O)O

InChI

InChI=1S/C39H51O3P/c1-24-33(29-20-18-25(36(2,3)4)22-31(29)38(8,9)10)34(27-16-14-15-17-28(27)35(24)43(40,41)42)30-21-19-26(37(5,6)7)23-32(30)39(11,12)13/h14-23H,1-13H3,(H2,40,41,42)