diethyl 2-acetamido-2-[[3-(dimethoxyphosphorylmethyl)-6,7-dimethoxy-quinoxalin-2-yl]methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[[3-(dimethoxyphosphorylmethyl)-6,7-dimethoxy-quinoxalin-2-yl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[3-(dimethoxyphosphorylmethyl)-6,7-dimethoxy-quinoxalin-2-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[3-(dimethoxyphosphorylmethyl)-6,7-dimethoxy-2-quinoxalinyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[3-(dimethoxyphosphorylmethyl)-6,7-dimethoxyquinoxalin-2-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[[3-(dimethoxyphosphorylmethyl)-6,7-dimethoxy-quinoxalin-2-yl]methyl]malonic acid diethyl ester Formula: C23H32N3O10P MolecularWeight: 541.488041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=NC2=CC(=C(C=C2N=C1CP(=O)(OC)OC)OC)OC)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=NC2=CC(=C(C=C2N=C1CP(=O)(OC)OC)OC)OC)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C23H32N3O10P/c1-8-35-21(28)23(26-14(3)27,22(29)36-9-2)12-17-18(13-37(30,33-6)34-7)25-16-11-20(32-5)19(31-4)10-15(16)24-17/h10-11H,8-9,12-13H2,1-7H3,(H,26,27)