1,3-dimethyl-5-nitro-6-[(E)-4-phenylbut-3-enyl]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-5-nitro-6-[(E)-4-phenylbut-3-enyl]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-5-nitro-6-[(E)-4-phenylbut-3-enyl]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-5-nitro-6-[(E)-4-phenylbut-3-enyl]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-5-nitro-6-[(E)-4-phenylbut-3-enyl]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-5-nitro-6-[(E)-4-phenylbut-3-enyl]pyrimidine-2,4-quinone Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)[N+](=O)[O-])CCC=CC2=CC=CC=C2

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)[N+](=O)[O-])CC/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H17N3O4/c1-17-13(11-7-6-10-12-8-4-3-5-9-12)14(19(22)23)15(20)18(2)16(17)21/h3-6,8-10H,7,11H2,1-2H3/b10-6+