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

Systemtic Name: 3-[1-(4-ethoxycarbonylphenyl)-5-phenyl-pyrrol-2-yl]propanoate Openeye Name: 3-[1-(4-ethoxycarbonylphenyl)-5-phenyl-pyrrol-2-yl]propanoate CAS Name: 3-[1-(4-ethoxycarbonylphenyl)-5-phenyl-2-pyrrolyl]propanoate IUPAC Name: 3-[1-(4-ethoxycarbonylphenyl)-5-phenylpyrrol-2-yl]propanoate Traditional Name: 3-[1-(4-carbethoxyphenyl)-5-phenyl-pyrrol-2-yl]propionate Formula: C22H20NO4- MolecularWeight: 362.3985

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21NO4/c1-2-27-22(26)17-8-10-18(11-9-17)23-19(13-15-21(24)25)12-14-20(23)16-6-4-3-5-7-16/h3-12,14H,2,13,15H2,1H3,(H,24,25)/p-1