[2-oxidanylidene-2-[[(1R)-1-phenylbutyl]amino]ethyl] quinoxaline-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-phenylbutyl]amino]ethyl] quinoxaline-6-carboxylate Openeye Name: [2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] quinoxaline-6-carboxylate CAS Name: 6-quinoxalinecarboxylic acid [2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] quinoxaline-6-carboxylate Traditional Name: quinoxaline-6-carboxylic acid [2-keto-2-[[(1R)-1-phenylbutyl]amino]ethyl] ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC3=NC=CN=C3C=C2

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)COC(=O)C2=CC3=NC=CN=C3C=C2

InChI

InChI=1S/C21H21N3O3/c1-2-6-17(15-7-4-3-5-8-15)24-20(25)14-27-21(26)16-9-10-18-19(13-16)23-12-11-22-18/h3-5,7-13,17H,2,6,14H2,1H3,(H,24,25)/t17-/m1/s1