[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-isocyanato-ethyl] propanoate

Systemtic Name: [2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-isocyanato-ethyl] propanoate Openeye Name: [2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-isocyanato-ethyl] propanoate CAS Name: propanoic acid [2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-isocyanatoethyl] ester IUPAC Name: [2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-isocyanatoethyl] propanoate Traditional Name: propionic acid [2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-isocyanato-ethyl] ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)N=C=O

Isomeric SMILES

CCC(=O)OCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)N=C=O

InChI

InChI=1S/C20H29NO4/c1-8-17(23)25-11-16(21-12-22)13-9-14(19(2,3)4)18(24)15(10-13)20(5,6)7/h9-10,16,24H,8,11H2,1-7H3