(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2H-chromene-3-carboxylate

Systemtic Name: (6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2H-chromene-3-carboxylate Openeye Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2H-chromene-3-carboxylate CAS Name: 2H-1-benzopyran-3-carboxylic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester IUPAC Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2H-chromene-3-carboxylate Traditional Name: 2H-chromene-3-carboxylic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester Formula: C20H17ClO5 MolecularWeight: 372.79898

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)COC(=O)C3=CC4=CC=CC=C4OC3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)COC(=O)C3=CC4=CC=CC=C4OC3)Cl)OC1

InChI

InChI=1S/C20H17ClO5/c21-16-8-13(9-18-19(16)24-7-3-6-23-18)11-26-20(22)15-10-14-4-1-2-5-17(14)25-12-15/h1-2,4-5,8-10H,3,6-7,11-12H2