1,3,6-trimethyl-5-nitro-4-(4-propoxyphenyl)-4H-pyrimidin-2-one

Systemtic Name: 1,3,6-trimethyl-5-nitro-4-(4-propoxyphenyl)-4H-pyrimidin-2-one Openeye Name: 1,3,6-trimethyl-5-nitro-4-(4-propoxyphenyl)-4H-pyrimidin-2-one CAS Name: 1,3,6-trimethyl-5-nitro-4-(4-propoxyphenyl)-4H-pyrimidin-2-one IUPAC Name: 1,3,6-trimethyl-5-nitro-4-(4-propoxyphenyl)-4H-pyrimidin-2-one Traditional Name: 1,3,6-trimethyl-5-nitro-4-(4-propoxyphenyl)-4H-pyrimidin-2-one Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O4/c1-5-10-23-13-8-6-12(7-9-13)15-14(19(21)22)11(2)17(3)16(20)18(15)4/h6-9,15H,5,10H2,1-4H3