(3S)-2-(9H-fluoren-9-ylmethoxycarbonyl)-1-phenylmethoxycarbonyl-1,2-diazinane-3-carboxylic acid

Systemtic Name: (3S)-2-(9H-fluoren-9-ylmethoxycarbonyl)-1-phenylmethoxycarbonyl-1,2-diazinane-3-carboxylic acid Openeye Name: (3S)-1-benzyloxycarbonyl-2-(9H-fluoren-9-ylmethoxycarbonyl)hexahydropyridazine-3-carboxylic acid CAS Name: (3S)-2-[9H-fluoren-9-ylmethoxy(oxo)methyl]-1-phenylmethoxycarbonyl-3-diazinanecarboxylic acid IUPAC Name: (3S)-2-(9H-fluoren-9-ylmethoxycarbonyl)-1-phenylmethoxycarbonyldiazinane-3-carboxylic acid Traditional Name: (3S)-1-carbobenzoxy-2-(9H-fluoren-9-ylmethoxycarbonyl)hexahydropyridazine-3-carboxylic acid Formula: C28H26N2O6 MolecularWeight: 486.51584

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O

Isomeric SMILES

C1C[C@H](N(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O

InChI

InChI=1S/C28H26N2O6/c31-26(32)25-15-8-16-29(27(33)35-17-19-9-2-1-3-10-19)30(25)28(34)36-18-24-22-13-6-4-11-20(22)21-12-5-7-14-23(21)24/h1-7,9-14,24-25H,8,15-18H2,(H,31,32)/t25-/m0/s1