[2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 1-ethyl-3-methyl-2-oxidanylidene-quinoxaline-6-carboxylate

Systemtic Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 1-ethyl-3-methyl-2-oxidanylidene-quinoxaline-6-carboxylate Openeye Name: [2-[[(1S)-1-methylhexyl]amino]-2-oxo-ethyl] 1-ethyl-3-methyl-2-oxo-quinoxaline-6-carboxylate CAS Name: 1-ethyl-3-methyl-2-oxo-6-quinoxalinecarboxylic acid [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] 1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxylate Traditional Name: 1-ethyl-2-keto-3-methyl-quinoxaline-6-carboxylic acid [2-keto-2-[[(1S)-1-methylhexyl]amino]ethyl] ester Formula: C21H29N3O4 MolecularWeight: 387.47266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)COC(=O)C1=CC2=C(C=C1)N(C(=O)C(=N2)C)CC

Isomeric SMILES

CCCCC[C@H](C)NC(=O)COC(=O)C1=CC2=C(C=C1)N(C(=O)C(=N2)C)CC

InChI

InChI=1S/C21H29N3O4/c1-5-7-8-9-14(3)22-19(25)13-28-21(27)16-10-11-18-17(12-16)23-15(4)20(26)24(18)6-2/h10-12,14H,5-9,13H2,1-4H3,(H,22,25)/t14-/m0/s1