1,2-bis[(3-nitrophenyl)methyl]-4-phenyl-1,2,4-triazolidine-3,5-dione

Systemtic Name: 1,2-bis[(3-nitrophenyl)methyl]-4-phenyl-1,2,4-triazolidine-3,5-dione Openeye Name: 1,2-bis[(3-nitrophenyl)methyl]-4-phenyl-1,2,4-triazolidine-3,5-dione CAS Name: 1,2-bis[(3-nitrophenyl)methyl]-4-phenyl-1,2,4-triazolidine-3,5-dione IUPAC Name: 1,2-bis[(3-nitrophenyl)methyl]-4-phenyl-1,2,4-triazolidine-3,5-dione Traditional Name: 1,2-bis(3-nitrobenzyl)-4-phenyl-urazole Formula: C22H17N5O6 MolecularWeight: 447.40028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)N(N(C2=O)CC3=CC(=CC=C3)[N+](=O)[O-])CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)N(N(C2=O)CC3=CC(=CC=C3)[N+](=O)[O-])CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O6/c28-21-23(14-16-6-4-10-19(12-16)26(30)31)24(15-17-7-5-11-20(13-17)27(32)33)22(29)25(21)18-8-2-1-3-9-18/h1-13H,14-15H2