6-[(4-chlorophenyl)methylamino]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-[(4-chlorophenyl)methylamino]-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-[(4-chlorophenyl)methylamino]-5-nitro-1H-pyrimidin-4-one CAS Name: 6-[(4-chlorophenyl)methylamino]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-[(4-chlorophenyl)methylamino]-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-[(4-chlorobenzyl)amino]-5-nitro-1H-pyrimidin-4-one Formula: C11H9ClN4O3 MolecularWeight: 280.66716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C(=O)N=CN2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C(=O)N=CN2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H9ClN4O3/c12-8-3-1-7(2-4-8)5-13-10-9(16(18)19)11(17)15-6-14-10/h1-4,6H,5H2,(H2,13,14,15,17)