3-[1-(2,4-dimethoxyphenyl)-5-phenyl-pyrrol-2-yl]propanoate

Systemtic Name: 3-[1-(2,4-dimethoxyphenyl)-5-phenyl-pyrrol-2-yl]propanoate Openeye Name: 3-[1-(2,4-dimethoxyphenyl)-5-phenyl-pyrrol-2-yl]propanoate CAS Name: 3-[1-(2,4-dimethoxyphenyl)-5-phenyl-2-pyrrolyl]propanoate IUPAC Name: 3-[1-(2,4-dimethoxyphenyl)-5-phenylpyrrol-2-yl]propanoate Traditional Name: 3-[1-(2,4-dimethoxyphenyl)-5-phenyl-pyrrol-2-yl]propionate Formula: C21H20NO4- MolecularWeight: 350.3878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=CC=C2C3=CC=CC=C3)CCC(=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=CC=C2C3=CC=CC=C3)CCC(=O)[O-])OC

InChI

InChI=1S/C21H21NO4/c1-25-17-10-12-19(20(14-17)26-2)22-16(9-13-21(23)24)8-11-18(22)15-6-4-3-5-7-15/h3-8,10-12,14H,9,13H2,1-2H3,(H,23,24)/p-1