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

Systemtic Name: (6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2,2-diphenylethanoate Openeye Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2,2-diphenylacetate CAS Name: 2,2-diphenylacetic 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 2,2-diphenylacetate Traditional Name: 2,2-diphenylacetic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester Formula: C24H21ClO4 MolecularWeight: 408.87414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)COC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)COC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)Cl)OC1

InChI

InChI=1S/C24H21ClO4/c25-20-14-17(15-21-23(20)28-13-7-12-27-21)16-29-24(26)22(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,14-15,22H,7,12-13,16H2