methyl 4-[4-(5-methoxy-1-benzothiophen-2-yl)phenoxy]butanoate

Systemtic Name: methyl 4-[4-(5-methoxy-1-benzothiophen-2-yl)phenoxy]butanoate Openeye Name: methyl 4-[4-(5-methoxybenzothiophen-2-yl)phenoxy]butanoate CAS Name: 4-[4-(5-methoxy-1-benzothiophen-2-yl)phenoxy]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(5-methoxy-1-benzothiophen-2-yl)phenoxy]butanoate Traditional Name: 4-[4-(5-methoxybenzothiophen-2-yl)phenoxy]butyric acid methyl ester Formula: C20H20O4S MolecularWeight: 356.4354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=C2)C3=CC=C(C=C3)OCCCC(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=C2)C3=CC=C(C=C3)OCCCC(=O)OC

InChI

InChI=1S/C20H20O4S/c1-22-17-9-10-18-15(12-17)13-19(25-18)14-5-7-16(8-6-14)24-11-3-4-20(21)23-2/h5-10,12-13H,3-4,11H2,1-2H3