(2R)-3-ethanoyl-1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-phenyl-2H-pyrrol-4-olate

Systemtic Name: (2R)-3-ethanoyl-1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-phenyl-2H-pyrrol-4-olate Openeye Name: (2R)-3-acetyl-1-(3-imidazol-1-ylpropyl)-5-oxo-2-phenyl-2H-pyrrol-4-olate CAS Name: (2R)-3-acetyl-1-[3-(1-imidazolyl)propyl]-5-oxo-2-phenyl-2H-pyrrol-4-olate IUPAC Name: (2R)-3-acetyl-1-(3-imidazol-1-ylpropyl)-5-oxo-2-phenyl-2H-pyrrol-4-olate Traditional Name: (5R)-4-acetyl-1-(3-imidazol-1-ylpropyl)-2-keto-5-phenyl-3-pyrrolin-3-olate Formula: C18H18N3O3- MolecularWeight: 324.35382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=CC=C2)CCCN3C=CN=C3)[O-]

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@@H]1C2=CC=CC=C2)CCCN3C=CN=C3)[O-]

InChI

InChI=1S/C18H19N3O3/c1-13(22)15-16(14-6-3-2-4-7-14)21(18(24)17(15)23)10-5-9-20-11-8-19-12-20/h2-4,6-8,11-12,16,23H,5,9-10H2,1H3/p-1/t16-/m1/s1