6-azanyl-1,3-dimethyl-5-[(1S)-1-(4-methylphenyl)-2-nitro-ethyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[(1S)-1-(4-methylphenyl)-2-nitro-ethyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1,3-dimethyl-5-[(1S)-2-nitro-1-(p-tolyl)ethyl]pyrimidine-2,4-dione CAS Name: 6-amino-1,3-dimethyl-5-[(1S)-1-(4-methylphenyl)-2-nitroethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1,3-dimethyl-5-[(1S)-1-(4-methylphenyl)-2-nitroethyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1,3-dimethyl-5-[(1S)-2-nitro-1-(p-tolyl)ethyl]pyrimidine-2,4-quinone Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[N+](=O)[O-])C2=C(N(C(=O)N(C2=O)C)C)N

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[N+](=O)[O-])C2=C(N(C(=O)N(C2=O)C)C)N

InChI

InChI=1S/C15H18N4O4/c1-9-4-6-10(7-5-9)11(8-19(22)23)12-13(16)17(2)15(21)18(3)14(12)20/h4-7,11H,8,16H2,1-3H3/t11-/m0/s1