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

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

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OC(C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OC(C5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C31H30O7/c1-4-20-16-23-26(18-25(20)38-30(31(33)34-5-2)21-10-7-6-8-11-21)37-19(3)28(29(23)32)22-12-13-24-27(17-22)36-15-9-14-35-24/h6-8,10-13,16-18,30H,4-5,9,14-15H2,1-3H3