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

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-phenacyloxy-6-propyl-chromen-4-one Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-phenacyloxy-6-propyl-chromen-4-one CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-phenacyloxy-6-propyl-1-benzopyran-4-one IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-phenacyloxy-6-propylchromen-4-one Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-7-phenacyloxy-6-propyl-chromone Formula: C29H26O6 MolecularWeight: 470.51314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC(=O)C5=CC=CC=C5

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H26O6/c1-2-7-21-14-22-27(16-26(21)35-18-24(30)19-8-4-3-5-9-19)34-17-23(29(22)31)20-10-11-25-28(15-20)33-13-6-12-32-25/h3-5,8-11,14-17H,2,6-7,12-13,18H2,1H3