3-[(4-methoxyphenyl)methyl]-6-methyl-5-nitro-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-6-methyl-5-nitro-1-propyl-pyrimidine-2,4-dione Openeye Name: 3-[(4-methoxyphenyl)methyl]-6-methyl-5-nitro-1-propyl-pyrimidine-2,4-dione CAS Name: 3-[(4-methoxyphenyl)methyl]-6-methyl-5-nitro-1-propylpyrimidine-2,4-dione IUPAC Name: 3-[(4-methoxyphenyl)methyl]-6-methyl-5-nitro-1-propylpyrimidine-2,4-dione Traditional Name: 6-methyl-5-nitro-3-p-anisyl-1-propyl-pyrimidine-2,4-quinone Formula: C16H19N3O5 MolecularWeight: 333.33916

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)CC2=CC=C(C=C2)OC)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)CC2=CC=C(C=C2)OC)[N+](=O)[O-])C

InChI

InChI=1S/C16H19N3O5/c1-4-9-17-11(2)14(19(22)23)15(20)18(16(17)21)10-12-5-7-13(24-3)8-6-12/h5-8H,4,9-10H2,1-3H3