3-[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]propanoic acid

Systemtic Name: 3-[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]propanoic acid Openeye Name: 3-[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]propanoic acid CAS Name: 3-[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]propanoic acid IUPAC Name: 3-[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]propanoic acid Traditional Name: 3-[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]propionic acid Formula: C29H36NO6P MolecularWeight: 525.573001

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OP(=O)(CCC(=O)O)C(CC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OP(=O)(CCC(=O)O)C(CC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H36NO6P/c31-27(32)11-12-37(34,36-29-17-23-13-24(18-29)15-25(14-23)19-29)26(16-21-7-3-1-4-8-21)30-28(33)35-20-22-9-5-2-6-10-22/h1-10,23-26H,11-20H2,(H,30,33)(H,31,32)