4-[(4-tert-butylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one

Systemtic Name: 4-[(4-tert-butylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one Openeye Name: 4-[(4-tert-butylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one CAS Name: 4-[(4-tert-butylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one IUPAC Name: 4-[(4-tert-butylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-(4-tert-butylbenzyl)oxy-5-nitro-1H-pyrimidin-6-one Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4/c1-15(2,3)11-6-4-10(5-7-11)8-22-14-12(18(20)21)13(19)16-9-17-14/h4-7,9H,8H2,1-3H3,(H,16,17,19)