(5E)-1-butyl-4,6-bis(oxidanylidene)-5-[(1-propylindol-3-yl)methylidene]pyrimidin-2-olate

Systemtic Name: (5E)-1-butyl-4,6-bis(oxidanylidene)-5-[(1-propylindol-3-yl)methylidene]pyrimidin-2-olate Openeye Name: (5E)-1-butyl-4,6-dioxo-5-[(1-propylindol-3-yl)methylene]pyrimidin-2-olate CAS Name: (5E)-1-butyl-4,6-dioxo-5-[(1-propyl-3-indolyl)methylidene]-2-pyrimidinolate IUPAC Name: (5E)-1-butyl-4,6-dioxo-5-[(1-propylindol-3-yl)methylidene]pyrimidin-2-olate Traditional Name: (5E)-1-butyl-4,6-diketo-5-[(1-propylindol-3-yl)methylene]pyrimidin-2-olate Formula: C20H22N3O3- MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CCC)C(=O)N=C1[O-]

Isomeric SMILES

CCCCN1C(=O)/C(=C/C2=CN(C3=CC=CC=C32)CCC)/C(=O)N=C1[O-]

InChI

InChI=1S/C20H23N3O3/c1-3-5-11-23-19(25)16(18(24)21-20(23)26)12-14-13-22(10-4-2)17-9-7-6-8-15(14)17/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,21,24,26)/p-1/b16-12+