1-(2-chloroethyl)-3-(3-imidazol-1-yl-2-oxidanyl-propyl)-1-nitroso-urea

Systemtic Name: 1-(2-chloroethyl)-3-(3-imidazol-1-yl-2-oxidanyl-propyl)-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-3-(2-hydroxy-3-imidazol-1-yl-propyl)-1-nitroso-urea CAS Name: 1-(2-chloroethyl)-3-[2-hydroxy-3-(1-imidazolyl)propyl]-1-nitrosourea IUPAC Name: 1-(2-chloroethyl)-3-(2-hydroxy-3-imidazol-1-ylpropyl)-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-(2-hydroxy-3-imidazol-1-yl-propyl)-1-nitroso-urea Formula: C9H14ClN5O3 MolecularWeight: 275.69216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CC(CNC(=O)N(CCCl)N=O)O

Isomeric SMILES

C1=CN(C=N1)CC(CNC(=O)N(CCCl)N=O)O

InChI

InChI=1S/C9H14ClN5O3/c10-1-3-15(13-18)9(17)12-5-8(16)6-14-4-2-11-7-14/h2,4,7-8,16H,1,3,5-6H2,(H,12,17)