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

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(2,5-dimethylphenyl)methoxy]-6-ethyl-chromen-4-one Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(2,5-dimethylphenyl)methoxy]-6-ethyl-chromen-4-one CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(2,5-dimethylphenyl)methoxy]-6-ethyl-1-benzopyran-4-one IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-[(2,5-dimethylphenyl)methoxy]-6-ethylchromen-4-one Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-(2,5-dimethylbenzyl)oxy-6-ethyl-chromone Formula: C29H28O5 MolecularWeight: 456.52962

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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=C(C=CC(=C5)C)C

Isomeric SMILES

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

InChI

InChI=1S/C29H28O5/c1-4-20-13-23-27(15-26(20)33-16-22-12-18(2)6-7-19(22)3)34-17-24(29(23)30)21-8-9-25-28(14-21)32-11-5-10-31-25/h6-9,12-15,17H,4-5,10-11,16H2,1-3H3