methyl 3-methyl-2-[(3-methyl-4-oxidanidyl-quinoxalin-4-ium-2-yl)carbonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[(3-methyl-4-oxidanidyl-quinoxalin-4-ium-2-yl)carbonylamino]butanoate Openeye Name: methyl 3-methyl-2-[(3-methyl-4-oxido-quinoxalin-4-ium-2-carbonyl)amino]butanoate CAS Name: 3-methyl-2-[[(3-methyl-4-oxido-2-quinoxalin-4-iumyl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(3-methyl-4-oxidoquinoxalin-4-ium-2-carbonyl)amino]butanoate Traditional Name: 3-methyl-2-[(3-methyl-4-oxido-quinoxalin-4-ium-2-carbonyl)amino]butyric acid methyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N=C1C(=O)NC(C(C)C)C(=O)OC)[O-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N=C1C(=O)NC(C(C)C)C(=O)OC)[O-]

InChI

InChI=1S/C16H19N3O4/c1-9(2)13(16(21)23-4)18-15(20)14-10(3)19(22)12-8-6-5-7-11(12)17-14/h5-9,13H,1-4H3,(H,18,20)