[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-phenylfuran-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-phenylfuran-2-carboxylate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 3-phenylfuran-2-carboxylate CAS Name: 3-phenyl-2-furancarboxylic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-phenylfuran-2-carboxylate Traditional Name: 3-phenylfuran-2-carboxylic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C18H21NO4 MolecularWeight: 315.36364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=C(C=CO1)C2=CC=CC=C2

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=C(C=CO1)C2=CC=CC=C2

InChI

InChI=1S/C18H21NO4/c1-3-7-13(2)19-16(20)12-23-18(21)17-15(10-11-22-17)14-8-5-4-6-9-14/h4-6,8-11,13H,3,7,12H2,1-2H3,(H,19,20)/t13-/m0/s1