methyl 2-[4-[5-(3-phenylpropyl)thiophen-2-yl]butoxy]ethanoate

Systemtic Name: methyl 2-[4-[5-(3-phenylpropyl)thiophen-2-yl]butoxy]ethanoate Openeye Name: methyl 2-[4-[5-(3-phenylpropyl)-2-thienyl]butoxy]acetate CAS Name: 2-[4-[5-(3-phenylpropyl)-2-thiophenyl]butoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[5-(3-phenylpropyl)thiophen-2-yl]butoxy]acetate Traditional Name: 2-[4-[5-(3-phenylpropyl)-2-thienyl]butoxy]acetic acid methyl ester Formula: C20H26O3S MolecularWeight: 346.48364

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COCCCCC1=CC=C(S1)CCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)COCCCCC1=CC=C(S1)CCCC2=CC=CC=C2

InChI

InChI=1S/C20H26O3S/c1-22-20(21)16-23-15-6-5-11-18-13-14-19(24-18)12-7-10-17-8-3-2-4-9-17/h2-4,8-9,13-14H,5-7,10-12,15-16H2,1H3