ethyl 3-[4-[2-[2-(5-bromanylthiophen-2-yl)-5-methyl-pyrrol-1-yl]ethoxy]phenyl]-2-ethoxy-propanoate

Systemtic Name: ethyl 3-[4-[2-[2-(5-bromanylthiophen-2-yl)-5-methyl-pyrrol-1-yl]ethoxy]phenyl]-2-ethoxy-propanoate Openeye Name: ethyl 3-[4-[2-[2-(5-bromo-2-thienyl)-5-methyl-pyrrol-1-yl]ethoxy]phenyl]-2-ethoxy-propanoate CAS Name: 3-[4-[2-[2-(5-bromo-2-thiophenyl)-5-methyl-1-pyrrolyl]ethoxy]phenyl]-2-ethoxypropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[2-[2-(5-bromothiophen-2-yl)-5-methylpyrrol-1-yl]ethoxy]phenyl]-2-ethoxypropanoate Traditional Name: 3-[4-[2-[2-(5-bromo-2-thienyl)-5-methyl-pyrrol-1-yl]ethoxy]phenyl]-2-ethoxy-propionic acid ethyl ester Formula: C24H28BrNO4S MolecularWeight: 506.45242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(S3)Br)C)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(S3)Br)C)C(=O)OCC

InChI

InChI=1S/C24H28BrNO4S/c1-4-28-21(24(27)29-5-2)16-18-7-9-19(10-8-18)30-15-14-26-17(3)6-11-20(26)22-12-13-23(25)31-22/h6-13,21H,4-5,14-16H2,1-3H3