1-(3-nitrophenyl)-5-(phenylmethylidene)-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-nitrophenyl)-5-(phenylmethylidene)-1,3-diazinane-2,4,6-trione Openeye Name: 5-benzylidene-1-(3-nitrophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-nitrophenyl)-5-(phenylmethylene)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-benzylidene-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-benzal-1-(3-nitrophenyl)barbituric acid Formula: C17H11N3O5 MolecularWeight: 337.28634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O5/c21-15-14(9-11-5-2-1-3-6-11)16(22)19(17(23)18-15)12-7-4-8-13(10-12)20(24)25/h1-10H,(H,18,21,23)