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

Systemtic Name: 1-[(4-nitrophenyl)methyl]-4-(phenylmethyl)-1,2,4-triazolidine-3,5-dione Openeye Name: 4-benzyl-1-[(4-nitrophenyl)methyl]-1,2,4-triazolidine-3,5-dione CAS Name: 1-[(4-nitrophenyl)methyl]-4-(phenylmethyl)-1,2,4-triazolidine-3,5-dione IUPAC Name: 4-benzyl-1-[(4-nitrophenyl)methyl]-1,2,4-triazolidine-3,5-dione Traditional Name: 4-benzyl-1-(4-nitrobenzyl)urazole Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)NN(C2=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)NN(C2=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4/c21-15-17-19(11-13-6-8-14(9-7-13)20(23)24)16(22)18(15)10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,21)