[1-(cyclopentylmethylsulfonyl)-3-(phenethylcarbamoylamino)propan-2-yl] dihydrogen phosphate

Systemtic Name: [1-(cyclopentylmethylsulfonyl)-3-(phenethylcarbamoylamino)propan-2-yl] dihydrogen phosphate Openeye Name: [1-(cyclopentylmethylsulfonylmethyl)-2-(phenethylcarbamoylamino)ethyl] dihydrogen phosphate CAS Name: [1-(cyclopentylmethylsulfonyl)-3-[[oxo-(phenethylamino)methyl]amino]propan-2-yl] dihydrogen phosphate IUPAC Name: [1-(cyclopentylmethylsulfonyl)-3-(phenethylcarbamoylamino)propan-2-yl] dihydrogen phosphate Traditional Name: [1-(cyclopentylmethylsulfonylmethyl)-2-(phenethylcarbamoylamino)ethyl] dihydrogen phosphate Formula: C18H29N2O7PS MolecularWeight: 448.470821

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CS(=O)(=O)CC(CNC(=O)NCCC2=CC=CC=C2)OP(=O)(O)O

Isomeric SMILES

C1CCC(C1)CS(=O)(=O)CC(CNC(=O)NCCC2=CC=CC=C2)OP(=O)(O)O

InChI

InChI=1S/C18H29N2O7PS/c21-18(19-11-10-15-6-2-1-3-7-15)20-12-17(27-28(22,23)24)14-29(25,26)13-16-8-4-5-9-16/h1-3,6-7,16-17H,4-5,8-14H2,(H2,19,20,21)(H2,22,23,24)