octadecyl 4-benzo[c][2,1]benzoxaphosphinin-6-yloxy-3,5-ditert-butyl-benzoate

Systemtic Name: octadecyl 4-benzo[c][2,1]benzoxaphosphinin-6-yloxy-3,5-ditert-butyl-benzoate Openeye Name: octadecyl 4-benzo[c][2,1]benzoxaphosphinin-6-yloxy-3,5-ditert-butyl-benzoate CAS Name: 4-(6-benzo[c][2,1]benzoxaphosphorinyloxy)-3,5-ditert-butylbenzoic acid octadecyl ester IUPAC Name: octadecyl 4-benzo[c][2,1]benzoxaphosphinin-6-yloxy-3,5-ditert-butylbenzoate Traditional Name: 4-benzo[c][2,1]benzoxaphosphorin-6-yloxy-3,5-ditert-butyl-benzoic acid stearyl ester Formula: C45H65O4P MolecularWeight: 700.968961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)C(C)(C)C)OP2C3=CC=CC=C3C4=CC=CC=C4O2)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)C(C)(C)C)OP2C3=CC=CC=C3C4=CC=CC=C4O2)C(C)(C)C

InChI

InChI=1S/C45H65O4P/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-32-47-43(46)35-33-38(44(2,3)4)42(39(34-35)45(5,6)7)49-50-41-31-26-24-29-37(41)36-28-23-25-30-40(36)48-50/h23-26,28-31,33-34H,8-22,27,32H2,1-7H3