[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl] 5-[(3R)-1,2-dithiolan-3-yl]pentanoate

Systemtic Name: [2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl] 5-[(3R)-1,2-dithiolan-3-yl]pentanoate Openeye Name: [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxo-ethyl] 5-[(3R)-dithiolan-3-yl]pentanoate CAS Name: 5-[(3R)-3-dithiolanyl]pentanoic acid [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl] 5-[(3R)-dithiolan-3-yl]pentanoate Traditional Name: 5-[(3R)-dithiolan-3-yl]valeric acid [2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)ethyl] ester Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)COC(=O)CCCCC3CCSS3)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)COC(=O)CCCC[C@@H]3CCSS3)C

InChI

InChI=1S/C20H26N2O4S2/c1-20(2)19(25)21-15-8-4-5-9-16(15)22(20)17(23)13-26-18(24)10-6-3-7-14-11-12-27-28-14/h4-5,8-9,14H,3,6-7,10-13H2,1-2H3,(H,21,25)/t14-/m1/s1