diethyl (2S)-2-[[4-[[(3-ethoxycarbonylquinoxalin-2-yl)amino]methyl]phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl (2S)-2-[[4-[[(3-ethoxycarbonylquinoxalin-2-yl)amino]methyl]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl (2S)-2-[[4-[[(3-ethoxycarbonylquinoxalin-2-yl)amino]methyl]benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[[4-[[(3-ethoxycarbonyl-2-quinoxalinyl)amino]methyl]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-[[4-[[(3-ethoxycarbonylquinoxalin-2-yl)amino]methyl]benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-[[(3-carbethoxyquinoxalin-2-yl)amino]methyl]benzoyl]amino]glutaric acid diethyl ester Formula: C28H32N4O7 MolecularWeight: 536.57628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3N=C2C(=O)OCC

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3N=C2C(=O)OCC

InChI

InChI=1S/C28H32N4O7/c1-4-37-23(33)16-15-22(27(35)38-5-2)32-26(34)19-13-11-18(12-14-19)17-29-25-24(28(36)39-6-3)30-20-9-7-8-10-21(20)31-25/h7-14,22H,4-6,15-17H2,1-3H3,(H,29,31)(H,32,34)/t22-/m0/s1