O1-tert-butyl O2-methyl (2R,4S,5R,6S)-5-[2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-6-dimethoxyphosphoryl-4-(2-methylpropyl)piperidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl (2R,4S,5R,6S)-5-[2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-6-dimethoxyphosphoryl-4-(2-methylpropyl)piperidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2R,4S,5R,6S)-6-dimethoxyphosphoryl-5-[2-(1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl]-4-isobutyl-piperidine-1,2-dicarboxylate CAS Name: (2R,4S,5R,6S)-6-dimethoxyphosphoryl-5-[2-(1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl]-4-(2-methylpropyl)piperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl (2R,4S,5R,6S)-6-dimethoxyphosphoryl-5-[2-(1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl]-4-(2-methylpropyl)piperidine-1,2-dicarboxylate Traditional Name: (2R,4S,5R,6S)-5-[2-(1,3-diketobenzo[de]isoquinolin-2-yl)ethyl]-6-dimethoxyphosphoryl-4-isobutyl-piperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C32H43N2O9P MolecularWeight: 630.665581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CC(N(C(C1CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)P(=O)(OC)OC)C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC(C)C[C@H]1C[C@@H](N([C@H]([C@@H]1CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)P(=O)(OC)OC)C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C32H43N2O9P/c1-19(2)17-21-18-25(30(37)40-6)34(31(38)43-32(3,4)5)29(44(39,41-7)42-8)22(21)15-16-33-27(35)23-13-9-11-20-12-10-14-24(26(20)23)28(33)36/h9-14,19,21-22,25,29H,15-18H2,1-8H3/t21-,22+,25+,29-/m0/s1