5-[(2-azanyl-2-oxidanylidene-ethyl)-ethyl-amino]pentan-2-yl [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate

Systemtic Name: 5-[(2-azanyl-2-oxidanylidene-ethyl)-ethyl-amino]pentan-2-yl [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate Openeye Name: [[4-[(2-amino-2-oxo-ethyl)-ethyl-amino]-1-methyl-butoxy]-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: 5-[(2-amino-2-oxoethyl)-ethylamino]pentan-2-yl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate IUPAC Name: 5-[(2-amino-2-oxoethyl)-ethylamino]pentan-2-yl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate Traditional Name: [[4-[(2-amino-2-keto-ethyl)-ethyl-amino]-1-methyl-butoxy]-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C9H23N2O11P3 MolecularWeight: 428.207003

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(C)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)CC(=O)N

Isomeric SMILES

CCN(CCCC(C)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)CC(=O)N

InChI

InChI=1S/C9H23N2O11P3/c1-3-11(7-9(10)12)6-4-5-8(2)20-24(16,17)22-25(18,19)21-23(13,14)15/h8H,3-7H2,1-2H3,(H2,10,12)(H,16,17)(H,18,19)(H2,13,14,15)