sodium 4-(2,4-dimethoxyphenyl)carbonyl-3-oxidanylidene-1-propan-2-yl-2H-pyrrol-5-olate

Systemtic Name: sodium 4-(2,4-dimethoxyphenyl)carbonyl-3-oxidanylidene-1-propan-2-yl-2H-pyrrol-5-olate Openeye Name: sodium 4-(2,4-dimethoxybenzoyl)-1-isopropyl-3-oxo-2H-pyrrol-5-olate CAS Name: sodium 4-[(2,4-dimethoxyphenyl)-oxomethyl]-3-oxo-1-propan-2-yl-2H-pyrrol-5-olate IUPAC Name: sodium 4-(2,4-dimethoxybenzoyl)-3-oxo-1-propan-2-yl-2H-pyrrol-5-olate Traditional Name: sodium 3-(2,4-dimethoxybenzoyl)-1-isopropyl-4-keto-2-pyrrolin-2-olate Formula: C16H18NNaO5 MolecularWeight: 327.30759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(=O)C(=C1[O-])C(=O)C2=C(C=C(C=C2)OC)OC.[Na+]

Isomeric SMILES

CC(C)N1CC(=O)C(=C1[O-])C(=O)C2=C(C=C(C=C2)OC)OC.[Na+]

InChI

InChI=1S/C16H19NO5.Na/c1-9(2)17-8-12(18)14(16(17)20)15(19)11-6-5-10(21-3)7-13(11)22-4;/h5-7,9,20H,8H2,1-4H3;/q;+1/p-1