[5-[(E)-hex-3-enoxy]-2-oxidanylidene-3-propan-2-yloxy-chromen-4-yl] benzoate

Systemtic Name: [5-[(E)-hex-3-enoxy]-2-oxidanylidene-3-propan-2-yloxy-chromen-4-yl] benzoate Openeye Name: [5-[(E)-hex-3-enoxy]-3-isopropoxy-2-oxo-chromen-4-yl] benzoate CAS Name: benzoic acid [5-[(E)-hex-3-enoxy]-2-oxo-3-propan-2-yloxy-1-benzopyran-4-yl] ester IUPAC Name: [5-[(E)-hex-3-enoxy]-2-oxo-3-propan-2-yloxychromen-4-yl] benzoate Traditional Name: benzoic acid [5-[(E)-hex-3-enoxy]-3-isopropoxy-2-keto-chromen-4-yl] ester Formula: C25H26O6 MolecularWeight: 422.47034

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCOC1=CC=CC2=C1C(=C(C(=O)O2)OC(C)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC/C=C/CCOC1=CC=CC2=C1C(=C(C(=O)O2)OC(C)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26O6/c1-4-5-6-10-16-28-19-14-11-15-20-21(19)22(23(25(27)30-20)29-17(2)3)31-24(26)18-12-8-7-9-13-18/h5-9,11-15,17H,4,10,16H2,1-3H3/b6-5+