4-azanyl-1-[4-(2,4-dinitrophenyl)butyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[4-(2,4-dinitrophenyl)butyl]pyrimidin-2-one Openeye Name: 4-amino-1-[4-(2,4-dinitrophenyl)butyl]pyrimidin-2-one CAS Name: 4-amino-1-[4-(2,4-dinitrophenyl)butyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[4-(2,4-dinitrophenyl)butyl]pyrimidin-2-one Traditional Name: 4-amino-1-[4-(2,4-dinitrophenyl)butyl]pyrimidin-2-one Formula: C14H15N5O5 MolecularWeight: 333.2994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CCCCN2C=CC(=NC2=O)N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CCCCN2C=CC(=NC2=O)N

InChI

InChI=1S/C14H15N5O5/c15-13-6-8-17(14(20)16-13)7-2-1-3-10-4-5-11(18(21)22)9-12(10)19(23)24/h4-6,8-9H,1-3,7H2,(H2,15,16,20)