3-[5-(4-bromophenyl)-1-(2-methoxyethyl)pyrrol-2-yl]propanoate

Systemtic Name: 3-[5-(4-bromophenyl)-1-(2-methoxyethyl)pyrrol-2-yl]propanoate Openeye Name: 3-[5-(4-bromophenyl)-1-(2-methoxyethyl)pyrrol-2-yl]propanoate CAS Name: 3-[5-(4-bromophenyl)-1-(2-methoxyethyl)-2-pyrrolyl]propanoate IUPAC Name: 3-[5-(4-bromophenyl)-1-(2-methoxyethyl)pyrrol-2-yl]propanoate Traditional Name: 3-[5-(4-bromophenyl)-1-(2-methoxyethyl)pyrrol-2-yl]propionate Formula: C16H17BrNO3- MolecularWeight: 351.21508

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=CC=C1C2=CC=C(C=C2)Br)CCC(=O)[O-]

Isomeric SMILES

COCCN1C(=CC=C1C2=CC=C(C=C2)Br)CCC(=O)[O-]

InChI

InChI=1S/C16H18BrNO3/c1-21-11-10-18-14(7-9-16(19)20)6-8-15(18)12-2-4-13(17)5-3-12/h2-6,8H,7,9-11H2,1H3,(H,19,20)/p-1