ethyl 3-(5-cyano-1-benzofuran-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate

Systemtic Name: ethyl 3-(5-cyano-1-benzofuran-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate Openeye Name: ethyl 3-(5-cyanobenzofuran-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate CAS Name: 3-(5-cyano-2-benzofuranyl)-2-[4-[(1-methyl-3-pyrrolidinyl)oxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(5-cyano-1-benzofuran-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propanoate Traditional Name: 3-(5-cyanobenzofuran-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)oxyphenyl]propionic acid ethyl ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(O1)C=CC(=C2)C#N)C3=CC=C(C=C3)OC4CCN(C4)C

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(O1)C=CC(=C2)C#N)C3=CC=C(C=C3)OC4CCN(C4)C

InChI

InChI=1S/C25H26N2O4/c1-3-29-25(28)23(14-22-13-19-12-17(15-26)4-9-24(19)31-22)18-5-7-20(8-6-18)30-21-10-11-27(2)16-21/h4-9,12-13,21,23H,3,10-11,14,16H2,1-2H3