1-[4-(4-nitrophenyl)piperazin-1-yl]-5-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-5-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-5-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 1-[4-(4-nitrophenyl)-1-piperazinyl]-5-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-5-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 1-[4-(4-nitrophenyl)piperazino]-5-phenyl-barbituric acid Formula: C20H19N5O5 MolecularWeight: 409.39536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C(C(=O)NC3=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C(C(=O)NC3=O)C4=CC=CC=C4

InChI

InChI=1S/C20H19N5O5/c26-18-17(14-4-2-1-3-5-14)19(27)24(20(28)21-18)23-12-10-22(11-13-23)15-6-8-16(9-7-15)25(29)30/h1-9,17H,10-13H2,(H,21,26,28)