N-[(2S,3S,5R)-5-aminocarbonyl-3,7-bis(oxidanyl)-1-phenyl-heptan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S,3S,5R)-5-aminocarbonyl-3,7-bis(oxidanyl)-1-phenyl-heptan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S,2S,4R)-1-benzyl-4-carbamoyl-2,6-dihydroxy-hexyl]quinoxaline-2-carboxamide CAS Name: N-[(2S,3S,5R)-5-carbamoyl-3,7-dihydroxy-1-phenylheptan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S,3S,5R)-5-carbamoyl-3,7-dihydroxy-1-phenylheptan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S,2S,4R)-1-benzyl-4-carbamoyl-2,6-dihydroxy-hexyl]quinoxaline-2-carboxamide Formula: C23H26N4O4 MolecularWeight: 422.47694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CC(CCO)C(=O)N)O)NC(=O)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H]([C@H](C[C@@H](CCO)C(=O)N)O)NC(=O)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C23H26N4O4/c24-22(30)16(10-11-28)13-21(29)19(12-15-6-2-1-3-7-15)27-23(31)20-14-25-17-8-4-5-9-18(17)26-20/h1-9,14,16,19,21,28-29H,10-13H2,(H2,24,30)(H,27,31)/t16-,19+,21+/m1/s1