ethyl 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-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)-2-methyl-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)-2-methyl-4-oxo-6-propyl-chromen-7-yl]oxy-2-phenyl-acetate CAS Name: 2-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-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)-2-methyl-4-oxo-6-propylchromen-7-yl]oxy-2-phenylacetate Traditional Name: 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-2-methyl-6-propyl-chromen-7-yl]oxy-2-phenyl-acetic acid ethyl ester Formula: C32H32O7 MolecularWeight: 528.59228

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

Isomeric SMILES

CCCC1=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/C32H32O7/c1-4-10-22-17-24-27(19-26(22)39-31(32(34)35-5-2)21-11-7-6-8-12-21)38-20(3)29(30(24)33)23-13-14-25-28(18-23)37-16-9-15-36-25/h6-8,11-14,17-19,31H,4-5,9-10,15-16H2,1-3H3