methyl N-[6-butyl-1-(phosphonooxymethyl)benzimidazol-2-yl]carbamate

Systemtic Name: methyl N-[6-butyl-1-(phosphonooxymethyl)benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-butyl-1-(phosphonooxymethyl)benzimidazol-2-yl]carbamate CAS Name: N-[6-butyl-1-(phosphonooxymethyl)-2-benzimidazolyl]carbamic acid methyl ester IUPAC Name: methyl N-[6-butyl-1-(phosphonooxymethyl)benzimidazol-2-yl]carbamate Traditional Name: N-[6-butyl-1-(phosphonooxymethyl)benzimidazol-2-yl]carbamic acid methyl ester Formula: C14H20N3O6P MolecularWeight: 357.298861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(N2COP(=O)(O)O)NC(=O)OC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(N2COP(=O)(O)O)NC(=O)OC

InChI

InChI=1S/C14H20N3O6P/c1-3-4-5-10-6-7-11-12(8-10)17(9-23-24(19,20)21)13(15-11)16-14(18)22-2/h6-8H,3-5,9H2,1-2H3,(H,15,16,18)(H2,19,20,21)