[2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-4-ethoxy-5-methoxy-phenyl] propanoate

Systemtic Name: [2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-4-ethoxy-5-methoxy-phenyl] propanoate Openeye Name: [2-[2-(5-cyanobenzothiophen-2-yl)ethyl]-4-ethoxy-5-methoxy-phenyl] propanoate CAS Name: propanoic acid [2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-4-ethoxy-5-methoxyphenyl] ester IUPAC Name: [2-[2-(5-cyano-1-benzothiophen-2-yl)ethyl]-4-ethoxy-5-methoxyphenyl] propanoate Traditional Name: propionic acid [2-[2-(5-cyanobenzothiophen-2-yl)ethyl]-4-ethoxy-5-methoxy-phenyl] ester Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC(=C(C=C1CCC2=CC3=C(S2)C=CC(=C3)C#N)OCC)OC

Isomeric SMILES

CCC(=O)OC1=CC(=C(C=C1CCC2=CC3=C(S2)C=CC(=C3)C#N)OCC)OC

InChI

InChI=1S/C23H23NO4S/c1-4-23(25)28-19-13-20(26-3)21(27-5-2)12-16(19)7-8-18-11-17-10-15(14-24)6-9-22(17)29-18/h6,9-13H,4-5,7-8H2,1-3H3