4-[(4R,5R)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-1,3-dioxan-2-yl]benzoic acid

Systemtic Name: 4-[(4R,5R)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-1,3-dioxan-2-yl]benzoic acid Openeye Name: 4-[(4R,5R)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-1,3-dioxan-2-yl]benzoic acid CAS Name: 4-[(4R,5R)-5-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-methyl-1,3-dioxan-2-yl]benzoic acid IUPAC Name: 4-[(4R,5R)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-1,3-dioxan-2-yl]benzoic acid Traditional Name: 4-[(4R,5R)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-1,3-dioxan-2-yl]benzoic acid Formula: C27H25NO6 MolecularWeight: 459.4905

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(COC(O1)C2=CC=C(C=C2)C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C[C@@H]1[C@@H](COC(O1)C2=CC=C(C=C2)C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C27H25NO6/c1-16-24(15-32-26(34-16)18-12-10-17(11-13-18)25(29)30)28-27(31)33-14-23-21-8-4-2-6-19(21)20-7-3-5-9-22(20)23/h2-13,16,23-24,26H,14-15H2,1H3,(H,28,31)(H,29,30)/t16-,24-,26?/m1/s1