ethyl (2S)-2-[[[[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]amino]-[[4-[[3-[(4-fluorophenyl)methyl]-4-oxidanyl-phenyl]methyl]-3,5-dimethyl-phenoxy]methyl]phosphoryl]amino]propanoate

Systemtic Name: ethyl (2S)-2-[[[[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]amino]-[[4-[[3-[(4-fluorophenyl)methyl]-4-oxidanyl-phenyl]methyl]-3,5-dimethyl-phenoxy]methyl]phosphoryl]amino]propanoate Openeye Name: ethyl (2S)-2-[[[[(1S)-2-ethoxy-1-methyl-2-oxo-ethyl]amino]-[[4-[[3-[(4-fluorophenyl)methyl]-4-hydroxy-phenyl]methyl]-3,5-dimethyl-phenoxy]methyl]phosphoryl]amino]propanoate CAS Name: (2S)-2-[[[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]-[[4-[[3-[(4-fluorophenyl)methyl]-4-hydroxyphenyl]methyl]-3,5-dimethylphenoxy]methyl]phosphoryl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[[[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]-[[4-[[3-[(4-fluorophenyl)methyl]-4-hydroxyphenyl]methyl]-3,5-dimethylphenoxy]methyl]phosphoryl]amino]propanoate Traditional Name: (2S)-2-[[[[(1S)-2-ethoxy-2-keto-1-methyl-ethyl]amino]-[[4-[3-(4-fluorobenzyl)-4-hydroxy-benzyl]-3,5-dimethyl-phenoxy]methyl]phosphoryl]amino]propionic acid ethyl ester Formula: C33H42FN2O7P MolecularWeight: 628.667944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)NP(=O)(COC1=CC(=C(C(=C1)C)CC2=CC(=C(C=C2)O)CC3=CC=C(C=C3)F)C)NC(C)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@H](C)NP(=O)(COC1=CC(=C(C(=C1)C)CC2=CC(=C(C=C2)O)CC3=CC=C(C=C3)F)C)N[C@@H](C)C(=O)OCC

InChI

InChI=1S/C33H42FN2O7P/c1-7-41-32(38)23(5)35-44(40,36-24(6)33(39)42-8-2)20-43-29-15-21(3)30(22(4)16-29)19-26-11-14-31(37)27(18-26)17-25-9-12-28(34)13-10-25/h9-16,18,23-24,37H,7-8,17,19-20H2,1-6H3,(H2,35,36,40)/t23-,24-/m0/s1