1-[(2-chlorophenyl)methyl]-4,6-bis(oxidanylidene)-5-(1H-pyrrol-2-ylmethylidene)pyrimidin-2-olate

Systemtic Name: 1-[(2-chlorophenyl)methyl]-4,6-bis(oxidanylidene)-5-(1H-pyrrol-2-ylmethylidene)pyrimidin-2-olate Openeye Name: 1-[(2-chlorophenyl)methyl]-4,6-dioxo-5-(1H-pyrrol-2-ylmethylene)pyrimidin-2-olate CAS Name: 1-[(2-chlorophenyl)methyl]-4,6-dioxo-5-(1H-pyrrol-2-ylmethylidene)-2-pyrimidinolate IUPAC Name: 1-[(2-chlorophenyl)methyl]-4,6-dioxo-5-(1H-pyrrol-2-ylmethylidene)pyrimidin-2-olate Traditional Name: 1-(2-chlorobenzyl)-4,6-diketo-5-(1H-pyrrol-2-ylmethylene)pyrimidin-2-olate Formula: C16H11ClN3O3- MolecularWeight: 328.72984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C(=CC3=CC=CN3)C(=O)N=C2[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C(=CC3=CC=CN3)C(=O)N=C2[O-])Cl

InChI

InChI=1S/C16H12ClN3O3/c17-13-6-2-1-4-10(13)9-20-15(22)12(14(21)19-16(20)23)8-11-5-3-7-18-11/h1-8,18H,9H2,(H,19,21,23)/p-1