ethyl 3-[2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-5-methoxy-phenyl]propanoate

Systemtic Name: ethyl 3-[2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-5-methoxy-phenyl]propanoate Openeye Name: ethyl 3-[2-[2-(5-cyanobenzothiophen-2-yl)ethyl]-5-methoxy-phenyl]propanoate CAS Name: 3-[2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-5-methoxyphenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-5-methoxyphenyl]propanoate Traditional Name: 3-[2-[2-(5-cyanobenzothiophen-2-yl)ethyl]-5-methoxy-phenyl]propionic acid ethyl ester Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C=CC(=C1)OC)CCC2=CC3=C(S2)C=CC(=C3)C#N

Isomeric SMILES

CCOC(=O)CCC1=C(C=CC(=C1)OC)CCC2=CC3=C(S2)C=CC(=C3)C#N

InChI

InChI=1S/C23H23NO3S/c1-3-27-23(25)11-7-18-13-20(26-2)8-5-17(18)6-9-21-14-19-12-16(15-24)4-10-22(19)28-21/h4-5,8,10,12-14H,3,6-7,9,11H2,1-2H3