1-[2-[(3,4-diethylpyrrol-1-yl)methyl]-4-methyl-5-(phenylcarbonyl)-1H-pyrrol-3-yl]propyl ethanoate

Systemtic Name: 1-[2-[(3,4-diethylpyrrol-1-yl)methyl]-4-methyl-5-(phenylcarbonyl)-1H-pyrrol-3-yl]propyl ethanoate Openeye Name: 1-[5-benzoyl-2-[(3,4-diethylpyrrol-1-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propyl acetate CAS Name: acetic acid 1-[5-benzoyl-2-[(3,4-diethyl-1-pyrrolyl)methyl]-4-methyl-1H-pyrrol-3-yl]propyl ester IUPAC Name: 1-[5-benzoyl-2-[(3,4-diethylpyrrol-1-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propyl acetate Traditional Name: acetic acid 1-[5-benzoyl-2-[(3,4-diethylpyrrol-1-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propyl ester Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C=C1CC)CC2=C(C(=C(N2)C(=O)C3=CC=CC=C3)C)C(CC)OC(=O)C

Isomeric SMILES

CCC1=CN(C=C1CC)CC2=C(C(=C(N2)C(=O)C3=CC=CC=C3)C)C(CC)OC(=O)C

InChI

InChI=1S/C26H32N2O3/c1-6-19-14-28(15-20(19)7-2)16-22-24(23(8-3)31-18(5)29)17(4)25(27-22)26(30)21-12-10-9-11-13-21/h9-15,23,27H,6-8,16H2,1-5H3