(5R)-5-azaniumyl-5-[2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-6-yl]pentanoate

Systemtic Name: (5R)-5-azaniumyl-5-[2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-6-yl]pentanoate Openeye Name: (5R)-5-azaniumyl-5-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)pentanoate CAS Name: (5R)-5-ammonio-5-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)pentanoate IUPAC Name: (5R)-5-azaniumyl-5-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)pentanoate Traditional Name: (5R)-5-ammonio-5-(2,3-diketo-1,4-dihydroquinoxalin-6-yl)valerate Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(CCCC(=O)[O-])[NH3+])NC(=O)C(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1[C@@H](CCCC(=O)[O-])[NH3+])NC(=O)C(=O)N2

InChI

InChI=1S/C13H15N3O4/c14-8(2-1-3-11(17)18)7-4-5-9-10(6-7)16-13(20)12(19)15-9/h4-6,8H,1-3,14H2,(H,15,19)(H,16,20)(H,17,18)/t8-/m1/s1