3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate; octylcyclodecane

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate; octylcyclodecane Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoate; octylcyclodecane CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate; octylcyclodecane IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate; octylcyclodecane Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionate; octylcyclodecane Formula: C35H61O3- MolecularWeight: 529.85704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCCCCCCCC1.CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)[O-]

Isomeric SMILES

CCCCCCCCC1CCCCCCCCC1.CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)[O-]

InChI

InChI=1S/C18H36.C17H26O3/c1-2-3-4-5-9-12-15-18-16-13-10-7-6-8-11-14-17-18;1-16(2,3)12-9-11(7-8-14(18)19)10-13(15(12)20)17(4,5)6/h18H,2-17H2,1H3;9-10,20H,7-8H2,1-6H3,(H,18,19)/p-1