[4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-5-yl]ethyl]amino]-3-oxidanylidene-propyl]phenyl] dihydrogen phosphate

Systemtic Name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-5-yl]ethyl]amino]-3-oxidanylidene-propyl]phenyl] dihydrogen phosphate Openeye Name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-5-yl]ethyl]amino]-3-oxo-propyl]phenyl] dihydrogen phosphate CAS Name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-5-yl]ethyl]amino]-3-oxopropyl]phenyl] dihydrogen phosphate IUPAC Name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-5-yl]ethyl]amino]-3-oxopropyl]phenyl] dihydrogen phosphate Traditional Name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-(4-chlorobenzyl)-1,2,4-oxadiazol-5-yl]ethyl]amino]-3-keto-propyl]phenyl] dihydrogen phosphate Formula: C22H24ClN4O7P MolecularWeight: 522.875321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)CC2=CC=C(C=C2)Cl)NC(=O)C(CC3=CC=C(C=C3)OP(=O)(O)O)NC(=O)C

Isomeric SMILES

C[C@@H](C1=NC(=NO1)CC2=CC=C(C=C2)Cl)NC(=O)[C@H](CC3=CC=C(C=C3)OP(=O)(O)O)NC(=O)C

InChI

InChI=1S/C22H24ClN4O7P/c1-13(22-26-20(27-33-22)12-16-3-7-17(23)8-4-16)24-21(29)19(25-14(2)28)11-15-5-9-18(10-6-15)34-35(30,31)32/h3-10,13,19H,11-12H2,1-2H3,(H,24,29)(H,25,28)(H2,30,31,32)/t13-,19-/m0/s1