[(E)-4-ethoxy-2-methyl-1-oxidanyl-4-oxidanylidene-but-2-enyl]-[(3S)-4-methoxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butyl]phosphinic acid

Systemtic Name: [(E)-4-ethoxy-2-methyl-1-oxidanyl-4-oxidanylidene-but-2-enyl]-[(3S)-4-methoxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butyl]phosphinic acid Openeye Name: [(3S)-3-(benzyloxycarbonylamino)-4-methoxy-4-oxo-butyl]-[(E)-4-ethoxy-1-hydroxy-2-methyl-4-oxo-but-2-enyl]phosphinic acid CAS Name: [(E)-4-ethoxy-1-hydroxy-2-methyl-4-oxobut-2-enyl]-[(3S)-4-methoxy-4-oxo-3-(phenylmethoxycarbonylamino)butyl]phosphinic acid IUPAC Name: [(E)-4-ethoxy-1-hydroxy-2-methyl-4-oxobut-2-enyl]-[(3S)-4-methoxy-4-oxo-3-(phenylmethoxycarbonylamino)butyl]phosphinic acid Traditional Name: [(3S)-3-(benzyloxycarbonylamino)-4-keto-4-methoxy-butyl]-[(E)-4-ethoxy-1-hydroxy-4-keto-2-methyl-but-2-enyl]phosphinic acid Formula: C20H28NO9P MolecularWeight: 457.411381

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C(O)P(=O)(CCC(C(=O)OC)NC(=O)OCC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)/C=C(\C)/C(O)P(=O)(CC[C@@H](C(=O)OC)NC(=O)OCC1=CC=CC=C1)O

InChI

InChI=1S/C20H28NO9P/c1-4-29-17(22)12-14(2)19(24)31(26,27)11-10-16(18(23)28-3)21-20(25)30-13-15-8-6-5-7-9-15/h5-9,12,16,19,24H,4,10-11,13H2,1-3H3,(H,21,25)(H,26,27)/b14-12+/t16-,19?/m0/s1