3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-phenylmethoxy-chromen-4-one

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-phenylmethoxy-chromen-4-one Openeye Name: 7-benzyloxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromen-4-one CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-phenylmethoxy-1-benzopyran-4-one IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-phenylmethoxychromen-4-one Traditional Name: 7-benzoxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-chromone Formula: C27H24O5 MolecularWeight: 428.47646

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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=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C27H24O5/c1-2-19-13-21-25(15-24(19)31-16-18-7-4-3-5-8-18)32-17-22(27(21)28)20-9-10-23-26(14-20)30-12-6-11-29-23/h3-5,7-10,13-15,17H,2,6,11-12,16H2,1H3