[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-(furan-2-yl)quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-(furan-2-yl)quinoline-4-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 2-(2-furyl)quinoline-4-carboxylate CAS Name: 2-(2-furanyl)-4-quinolinecarboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 2-(furan-2-yl)quinoline-4-carboxylate Traditional Name: 2-(2-furyl)cinchoninic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CO3

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CO3

InChI

InChI=1S/C21H22N2O4/c1-3-7-14(2)22-20(24)13-27-21(25)16-12-18(19-10-6-11-26-19)23-17-9-5-4-8-15(16)17/h4-6,8-12,14H,3,7,13H2,1-2H3,(H,22,24)