2-[3-chloranyl-5-(2-cyclobutylethylamino)-2-methyl-6-oxidanylidene-pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-chloranyl-5-(2-cyclobutylethylamino)-2-methyl-6-oxidanylidene-pyrazin-1-yl]ethanoic acid Openeye Name: 2-[3-chloro-5-(2-cyclobutylethylamino)-2-methyl-6-oxo-pyrazin-1-yl]acetic acid CAS Name: 2-[3-chloro-5-(2-cyclobutylethylamino)-2-methyl-6-oxo-1-pyrazinyl]acetic acid IUPAC Name: 2-[3-chloro-5-(2-cyclobutylethylamino)-2-methyl-6-oxopyrazin-1-yl]acetic acid Traditional Name: 2-[5-chloro-3-(2-cyclobutylethylamino)-2-keto-6-methyl-pyrazin-1-yl]acetic acid Formula: C13H18ClN3O3 MolecularWeight: 299.75332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=O)N1CC(=O)O)NCCC2CCC2)Cl

Isomeric SMILES

CC1=C(N=C(C(=O)N1CC(=O)O)NCCC2CCC2)Cl

InChI

InChI=1S/C13H18ClN3O3/c1-8-11(14)16-12(13(20)17(8)7-10(18)19)15-6-5-9-3-2-4-9/h9H,2-7H2,1H3,(H,15,16)(H,18,19)