[(3S)-2-oxidanylideneoxolan-3-yl] 6-methoxy-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 6-methoxy-2-phenyl-quinoline-4-carboxylate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 6-methoxy-2-phenyl-quinoline-4-carboxylate CAS Name: 6-methoxy-2-phenyl-4-quinolinecarboxylic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 6-methoxy-2-phenylquinoline-4-carboxylate Traditional Name: 6-methoxy-2-phenyl-cinchoninic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2C(=O)OC3CCOC3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2C(=O)O[C@H]3CCOC3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17NO5/c1-25-14-7-8-17-15(11-14)16(20(23)27-19-9-10-26-21(19)24)12-18(22-17)13-5-3-2-4-6-13/h2-8,11-12,19H,9-10H2,1H3/t19-/m0/s1