ethyl (2E,4E,6E)-7-[3-tert-butyl-5-(2-methyl-1-oxidanylidene-1-tritio-propan-2-yl)phenyl]-3-methyl-octa-2,4,6-trienoate

Systemtic Name: ethyl (2E,4E,6E)-7-[3-tert-butyl-5-(2-methyl-1-oxidanylidene-1-tritio-propan-2-yl)phenyl]-3-methyl-octa-2,4,6-trienoate Openeye Name: ethyl (2E,4E,6E)-7-[3-tert-butyl-5-(1,1-dimethyl-2-oxo-2-tritio-ethyl)phenyl]-3-methyl-octa-2,4,6-trienoate CAS Name: (2E,4E,6E)-7-[3-tert-butyl-5-(2-methyl-1-oxo-1-tritiopropan-2-yl)phenyl]-3-methylocta-2,4,6-trienoic acid ethyl ester IUPAC Name: ethyl (2E,4E,6E)-7-[3-tert-butyl-5-(2-methyl-1-oxo-1-tritiopropan-2-yl)phenyl]-3-methylocta-2,4,6-trienoate Traditional Name: (2E,4E,6E)-7-[3-tert-butyl-5-(2-keto-1,1-dimethyl-2-tritio-ethyl)phenyl]-3-methyl-octa-2,4,6-trienoic acid ethyl ester Formula: C25H34O3 MolecularWeight: 384.543769

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C=CC=C(C)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C=O

Isomeric SMILES

[3H]C(=O)C(C)(C)C1=CC(=CC(=C1)/C(=C/C=C/C(=C/C(=O)OCC)/C)/C)C(C)(C)C

InChI

InChI=1S/C25H34O3/c1-9-28-23(27)13-18(2)11-10-12-19(3)20-14-21(24(4,5)6)16-22(15-20)25(7,8)17-26/h10-17H,9H2,1-8H3/b11-10+,18-13+,19-12+/i17T