7-[(3,4-dichlorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromen-4-one

Systemtic Name: 7-[(3,4-dichlorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromen-4-one Openeye Name: 7-[(3,4-dichlorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromen-4-one CAS Name: 7-[(3,4-dichlorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-1-benzopyran-4-one IUPAC Name: 7-[(3,4-dichlorophenyl)methoxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethylchromen-4-one Traditional Name: 7-(3,4-dichlorobenzyl)oxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromone Formula: C27H22Cl2O5 MolecularWeight: 497.36658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C27H22Cl2O5/c1-2-17-11-19-25(13-24(17)33-14-16-4-6-21(28)22(29)10-16)34-15-20(27(19)30)18-5-7-23-26(12-18)32-9-3-8-31-23/h4-7,10-13,15H,2-3,8-9,14H2,1H3