[(2S)-2-ethoxycarbonylpent-4-ynyl]-[(1S)-3-methyl-1-(phenylmethoxycarbonylamino)butyl]phosphinic acid

Systemtic Name: [(2S)-2-ethoxycarbonylpent-4-ynyl]-[(1S)-3-methyl-1-(phenylmethoxycarbonylamino)butyl]phosphinic acid Openeye Name: [(1S)-1-(benzyloxycarbonylamino)-3-methyl-butyl]-[(2S)-2-ethoxycarbonylpent-4-ynyl]phosphinic acid CAS Name: [(2S)-2-ethoxycarbonylpent-4-ynyl]-[(1S)-3-methyl-1-(phenylmethoxycarbonylamino)butyl]phosphinic acid IUPAC Name: [(2S)-2-ethoxycarbonylpent-4-ynyl]-[(1S)-3-methyl-1-(phenylmethoxycarbonylamino)butyl]phosphinic acid Traditional Name: [(1S)-1-(benzyloxycarbonylamino)-3-methyl-butyl]-[(2S)-2-carbethoxypent-4-ynyl]phosphinic acid Formula: C21H30NO6P MolecularWeight: 423.439761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#C)CP(=O)(C(CC(C)C)NC(=O)OCC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)[C@H](CC#C)CP(=O)([C@@H](CC(C)C)NC(=O)OCC1=CC=CC=C1)O

InChI

InChI=1S/C21H30NO6P/c1-5-10-18(20(23)27-6-2)15-29(25,26)19(13-16(3)4)22-21(24)28-14-17-11-8-7-9-12-17/h1,7-9,11-12,16,18-19H,6,10,13-15H2,2-4H3,(H,22,24)(H,25,26)/t18-,19+/m1/s1