3-[(1R)-1-[[(2S)-3-[(4-methoxyphenyl)methyl-oxidanyl-phosphoryl]-2-oxidanyl-propyl]amino]ethyl]benzoic acid

Systemtic Name: 3-[(1R)-1-[[(2S)-3-[(4-methoxyphenyl)methyl-oxidanyl-phosphoryl]-2-oxidanyl-propyl]amino]ethyl]benzoic acid Openeye Name: 3-[(1R)-1-[[(2S)-2-hydroxy-3-[hydroxy-[(4-methoxyphenyl)methyl]phosphoryl]propyl]amino]ethyl]benzoic acid CAS Name: 3-[(1R)-1-[[(2S)-2-hydroxy-3-[hydroxy-[(4-methoxyphenyl)methyl]phosphoryl]propyl]amino]ethyl]benzoic acid IUPAC Name: 3-[(1R)-1-[[(2S)-2-hydroxy-3-[hydroxy-[(4-methoxyphenyl)methyl]phosphoryl]propyl]amino]ethyl]benzoic acid Traditional Name: 3-[(1R)-1-[[(2S)-2-hydroxy-3-[hydroxy(p-anisyl)phosphoryl]propyl]amino]ethyl]benzoic acid Formula: C20H26NO6P MolecularWeight: 407.397301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)O)NCC(CP(=O)(CC2=CC=C(C=C2)OC)O)O

Isomeric SMILES

C[C@H](C1=CC=CC(=C1)C(=O)O)NC[C@@H](CP(=O)(CC2=CC=C(C=C2)OC)O)O

InChI

InChI=1S/C20H26NO6P/c1-14(16-4-3-5-17(10-16)20(23)24)21-11-18(22)13-28(25,26)12-15-6-8-19(27-2)9-7-15/h3-10,14,18,21-22H,11-13H2,1-2H3,(H,23,24)(H,25,26)/t14-,18+/m1/s1