(4R)-4-(3-methoxy-4-propoxy-phenyl)-1,3,6-trimethyl-5-nitro-4H-pyrimidin-2-one

Systemtic Name: (4R)-4-(3-methoxy-4-propoxy-phenyl)-1,3,6-trimethyl-5-nitro-4H-pyrimidin-2-one Openeye Name: (4R)-4-(3-methoxy-4-propoxy-phenyl)-1,3,6-trimethyl-5-nitro-4H-pyrimidin-2-one CAS Name: (4R)-4-(3-methoxy-4-propoxyphenyl)-1,3,6-trimethyl-5-nitro-4H-pyrimidin-2-one IUPAC Name: (4R)-4-(3-methoxy-4-propoxyphenyl)-1,3,6-trimethyl-5-nitro-4H-pyrimidin-2-one Traditional Name: (4R)-4-(3-methoxy-4-propoxy-phenyl)-1,3,6-trimethyl-5-nitro-4H-pyrimidin-2-one Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(N(C(=O)N2C)C)C)[N+](=O)[O-])OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@@H]2C(=C(N(C(=O)N2C)C)C)[N+](=O)[O-])OC

InChI

InChI=1S/C17H23N3O5/c1-6-9-25-13-8-7-12(10-14(13)24-5)16-15(20(22)23)11(2)18(3)17(21)19(16)4/h7-8,10,16H,6,9H2,1-5H3/t16-/m1/s1