(phenylmethyl) 4-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl]benzoate

Systemtic Name: (phenylmethyl) 4-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl]benzoate Openeye Name: benzyl 4-[2-(4-methoxybenzothiophen-3-yl)ethyl]benzoate CAS Name: 4-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-(4-methoxy-1-benzothiophen-3-yl)ethyl]benzoate Traditional Name: 4-[2-(4-methoxybenzothiophen-3-yl)ethyl]benzoic acid benzyl ester Formula: C25H22O3S MolecularWeight: 402.50538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC=C2CCC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=CC=C1)SC=C2CCC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22O3S/c1-27-22-8-5-9-23-24(22)21(17-29-23)15-12-18-10-13-20(14-11-18)25(26)28-16-19-6-3-2-4-7-19/h2-11,13-14,17H,12,15-16H2,1H3