(2-oxidanylidenechromen-6-yl) 4-(4-heptoxyphenyl)benzoate

Systemtic Name: (2-oxidanylidenechromen-6-yl) 4-(4-heptoxyphenyl)benzoate Openeye Name: (2-oxochromen-6-yl) 4-(4-heptoxyphenyl)benzoate CAS Name: 4-(4-heptoxyphenyl)benzoic acid (2-oxo-1-benzopyran-6-yl) ester IUPAC Name: (2-oxochromen-6-yl) 4-(4-heptoxyphenyl)benzoate Traditional Name: 4-(4-heptoxyphenyl)benzoic acid (2-ketochromen-6-yl) ester Formula: C29H28O5 MolecularWeight: 456.52962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)OC(=O)C=C4

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)OC(=O)C=C4

InChI

InChI=1S/C29H28O5/c1-2-3-4-5-6-19-32-25-14-11-22(12-15-25)21-7-9-23(10-8-21)29(31)33-26-16-17-27-24(20-26)13-18-28(30)34-27/h7-18,20H,2-6,19H2,1H3