6-azanyl-1,3-dimethyl-5-(1-nitro-4-phenyl-but-3-en-2-yl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-(1-nitro-4-phenyl-but-3-en-2-yl)pyrimidine-2,4-dione Openeye Name: 6-amino-1,3-dimethyl-5-[1-(nitromethyl)-3-phenyl-allyl]pyrimidine-2,4-dione CAS Name: 6-amino-1,3-dimethyl-5-(1-nitro-4-phenylbut-3-en-2-yl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1,3-dimethyl-5-(1-nitro-4-phenylbut-3-en-2-yl)pyrimidine-2,4-dione Traditional Name: 6-amino-1,3-dimethyl-5-[1-(nitromethyl)-3-phenyl-allyl]pyrimidine-2,4-quinone Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O4/c1-18-14(17)13(15(21)19(2)16(18)22)12(10-20(23)24)9-8-11-6-4-3-5-7-11/h3-9,12H,10,17H2,1-2H3