5-(1-azidoethenyl)-1-[3-(hydroxymethyl)-4-oxidanyl-butyl]pyrimidine-2,4-dione

Systemtic Name: 5-(1-azidoethenyl)-1-[3-(hydroxymethyl)-4-oxidanyl-butyl]pyrimidine-2,4-dione Openeye Name: 5-(1-azidovinyl)-1-[4-hydroxy-3-(hydroxymethyl)butyl]pyrimidine-2,4-dione CAS Name: 5-(1-azidoethenyl)-1-[4-hydroxy-3-(hydroxymethyl)butyl]pyrimidine-2,4-dione IUPAC Name: 5-(1-azidoethenyl)-1-[4-hydroxy-3-(hydroxymethyl)butyl]pyrimidine-2,4-dione Traditional Name: 5-(1-azidovinyl)-1-(4-hydroxy-3-methylol-butyl)pyrimidine-2,4-quinone Formula: C11H15N5O4 MolecularWeight: 281.2679

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CN(C(=O)NC1=O)CCC(CO)CO)N=[N+]=[N-]

Isomeric SMILES

C=C(C1=CN(C(=O)NC1=O)CCC(CO)CO)N=[N+]=[N-]

InChI

InChI=1S/C11H15N5O4/c1-7(14-15-12)9-4-16(11(20)13-10(9)19)3-2-8(5-17)6-18/h4,8,17-18H,1-3,5-6H2,(H,13,19,20)