ethyl 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-6-propyl-chromen-7-yl]oxy-2-phenyl-ethanoate

Systemtic Name: ethyl 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-6-propyl-chromen-7-yl]oxy-2-phenyl-ethanoate Openeye Name: ethyl 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-6-propyl-chromen-7-yl]oxy-2-phenyl-acetate CAS Name: 2-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-6-propyl-1-benzopyran-7-yl]oxy]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-6-propylchromen-7-yl]oxy-2-phenylacetate Traditional Name: 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-6-propyl-chromen-7-yl]oxy-2-phenyl-acetic acid ethyl ester Formula: C31H30O7 MolecularWeight: 514.5657

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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)OC(C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C31H30O7/c1-3-9-22-16-23-27(18-26(22)38-30(31(33)34-4-2)20-10-6-5-7-11-20)37-19-24(29(23)32)21-12-13-25-28(17-21)36-15-8-14-35-25/h5-7,10-13,16-19,30H,3-4,8-9,14-15H2,1-2H3