(phenylmethyl) 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxidanylidene-6-propyl-chromen-7-yl]oxyethanoate

Systemtic Name: (phenylmethyl) 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxidanylidene-6-propyl-chromen-7-yl]oxyethanoate Openeye Name: benzyl 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propyl-chromen-7-yl]oxyacetate CAS Name: 2-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propyl-1-benzopyran-7-yl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propylchromen-7-yl]oxyacetate Traditional Name: 2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-2-methyl-6-propyl-chromen-7-yl]oxyacetic acid benzyl ester Formula: C31H30O7 MolecularWeight: 514.5657

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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)OCC(=O)OCC5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C31H30O7/c1-3-8-22-15-24-27(17-26(22)36-19-29(32)37-18-21-9-5-4-6-10-21)38-20(2)30(31(24)33)23-11-12-25-28(16-23)35-14-7-13-34-25/h4-6,9-12,15-17H,3,7-8,13-14,18-19H2,1-2H3