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

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-7-phenylmethoxy-6-propyl-chromen-4-one Openeye Name: 7-benzyloxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-6-propyl-chromen-4-one CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-7-phenylmethoxy-6-propyl-1-benzopyran-4-one IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-7-phenylmethoxy-6-propylchromen-4-one Traditional Name: 7-benzoxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-6-propyl-chromone Formula: C29H28O5 MolecularWeight: 456.52962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=CC=CC=C5

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H28O5/c1-3-8-21-15-23-26(17-25(21)33-18-20-9-5-4-6-10-20)34-19(2)28(29(23)30)22-11-12-24-27(16-22)32-14-7-13-31-24/h4-6,9-12,15-17H,3,7-8,13-14,18H2,1-2H3