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

Systemtic Name: [3-(3,5-ditert-butyl-2-methoxy-phenyl)-3-methoxy-prop-1-ynyl] benzoate Openeye Name: [3-(3,5-ditert-butyl-2-methoxy-phenyl)-3-methoxy-prop-1-ynyl] benzoate CAS Name: benzoic acid [3-(3,5-ditert-butyl-2-methoxyphenyl)-3-methoxyprop-1-ynyl] ester IUPAC Name: [3-(3,5-ditert-butyl-2-methoxyphenyl)-3-methoxyprop-1-ynyl] benzoate Traditional Name: benzoic acid [3-(3,5-ditert-butyl-2-methoxy-phenyl)-3-methoxy-prop-1-ynyl] ester Formula: C26H32O4 MolecularWeight: 408.52988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32O4/c1-25(2,3)19-16-20(23(29-8)21(17-19)26(4,5)6)22(28-7)14-15-30-24(27)18-12-10-9-11-13-18/h9-13,16-17,22H,1-8H3