(phenylmethyl) 3-(1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoate

Systemtic Name: (phenylmethyl) 3-(1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoate Openeye Name: benzyl 3-(benzothiophen-2-yl)-2-(4-isopropylphenyl)-2-methyl-propanoate CAS Name: 3-(1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoate Traditional Name: 3-(benzothiophen-2-yl)-2-methyl-2-p-cumenyl-propionic acid benzyl ester Formula: C28H28O2S MolecularWeight: 428.58572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C)(CC2=CC3=CC=CC=C3S2)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C)(CC2=CC3=CC=CC=C3S2)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28O2S/c1-20(2)22-13-15-24(16-14-22)28(3,27(29)30-19-21-9-5-4-6-10-21)18-25-17-23-11-7-8-12-26(23)31-25/h4-17,20H,18-19H2,1-3H3