(4Z)-3-ethanoyl-4-(1-oxidanylethylidene)-3-(1H-pyrrol-2-yl)hexane-2,5-dione

Systemtic Name: (4Z)-3-ethanoyl-4-(1-oxidanylethylidene)-3-(1H-pyrrol-2-yl)hexane-2,5-dione Openeye Name: (4Z)-3-acetyl-4-(1-hydroxyethylidene)-3-(1H-pyrrol-2-yl)hexane-2,5-dione CAS Name: (4Z)-3-acetyl-4-(1-hydroxyethylidene)-3-(1H-pyrrol-2-yl)hexane-2,5-dione IUPAC Name: (4Z)-3-acetyl-4-(1-hydroxyethylidene)-3-(1H-pyrrol-2-yl)hexane-2,5-dione Traditional Name: (4Z)-3-acetyl-4-(1-hydroxyethylidene)-3-(1H-pyrrol-2-yl)hexane-2,5-dione Formula: C14H17NO4 MolecularWeight: 263.28908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)C(C1=CC=CN1)(C(=O)C)C(=O)C)O

Isomeric SMILES

C/C(=C(/C(=O)C)\C(C1=CC=CN1)(C(=O)C)C(=O)C)/O

InChI

InChI=1S/C14H17NO4/c1-8(16)13(9(2)17)14(10(3)18,11(4)19)12-6-5-7-15-12/h5-7,15-16H,1-4H3/b13-8+