2-[[4-[(2,3-dimethoxyquinoxalin-6-yl)methylamino]naphthalen-1-yl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[(2,3-dimethoxyquinoxalin-6-yl)methylamino]naphthalen-1-yl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[(2,3-dimethoxyquinoxalin-6-yl)methylamino]naphthalene-1-carbonyl]amino]pentanedioic acid CAS Name: 2-[[[4-[(2,3-dimethoxy-6-quinoxalinyl)methylamino]-1-naphthalenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[(2,3-dimethoxyquinoxalin-6-yl)methylamino]naphthalene-1-carbonyl]amino]pentanedioic acid Traditional Name: 2-[[4-[(2,3-dimethoxyquinoxalin-6-yl)methylamino]-1-naphthoyl]amino]glutaric acid Formula: C27H26N4O7 MolecularWeight: 518.51794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=C(C=C2)CNC3=CC=C(C4=CC=CC=C43)C(=O)NC(CCC(=O)O)C(=O)O)N=C1OC

Isomeric SMILES

COC1=NC2=C(C=C(C=C2)CNC3=CC=C(C4=CC=CC=C43)C(=O)NC(CCC(=O)O)C(=O)O)N=C1OC

InChI

InChI=1S/C27H26N4O7/c1-37-25-26(38-2)31-22-13-15(7-9-20(22)30-25)14-28-19-10-8-18(16-5-3-4-6-17(16)19)24(34)29-21(27(35)36)11-12-23(32)33/h3-10,13,21,28H,11-12,14H2,1-2H3,(H,29,34)(H,32,33)(H,35,36)