[3-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]-3-oxidanyl-prop-1-ynyl] benzoate

Systemtic Name: [3-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]-3-oxidanyl-prop-1-ynyl] benzoate Openeye Name: [3-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]-3-hydroxy-prop-1-ynyl] benzoate CAS Name: benzoic acid [3-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]-3-hydroxyprop-1-ynyl] ester IUPAC Name: [3-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]-3-hydroxyprop-1-ynyl] benzoate Traditional Name: benzoic acid [3-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]-3-hydroxy-prop-1-ynyl] ester Formula: C26H32O5 MolecularWeight: 424.52928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)OCOC)C(C#COC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)OCOC)C(C#COC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C26H32O5/c1-25(2,3)19-15-20(23(31-17-29-7)21(16-19)26(4,5)6)22(27)13-14-30-24(28)18-11-9-8-10-12-18/h8-12,15-16,22,27H,17H2,1-7H3