6-[(2S)-2-(4-dimethylaminophenyl)-3-ethanoyl-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]hexanoate

Systemtic Name: 6-[(2S)-2-(4-dimethylaminophenyl)-3-ethanoyl-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]hexanoate Openeye Name: 6-[(2S)-3-acetyl-2-(4-dimethylaminophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]hexanoate CAS Name: 6-[(2S)-3-acetyl-2-(4-dimethylaminophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]hexanoate IUPAC Name: 6-[(2S)-3-acetyl-2-(4-dimethylaminophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]hexanoate Traditional Name: 6-[(2S)-3-acetyl-2-(4-dimethylaminophenyl)-5-keto-4-oxido-3-pyrrolin-1-yl]hexanoate Formula: C20H24N2O5-2 MolecularWeight: 372.41496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)N(C)C)CCCCCC(=O)[O-])[O-]

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@H]1C2=CC=C(C=C2)N(C)C)CCCCCC(=O)[O-])[O-]

InChI

InChI=1S/C20H26N2O5/c1-13(23)17-18(14-8-10-15(11-9-14)21(2)3)22(20(27)19(17)26)12-6-4-5-7-16(24)25/h8-11,18,26H,4-7,12H2,1-3H3,(H,24,25)/p-2/t18-/m0/s1