quinolin-8-ylmethyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate

Systemtic Name: quinolin-8-ylmethyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Openeye Name: 8-quinolylmethyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid 8-quinolylmethyl ester Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4)OC1

InChI

InChI=1S/C20H17NO4/c22-20(15-7-8-17-18(12-15)24-11-3-10-23-17)25-13-16-5-1-4-14-6-2-9-21-19(14)16/h1-2,4-9,12H,3,10-11,13H2