3-hexyl-4-methyl-7-phenacyloxy-chromen-2-one

Systemtic Name: 3-hexyl-4-methyl-7-phenacyloxy-chromen-2-one Openeye Name: 3-hexyl-4-methyl-7-phenacyloxy-chromen-2-one CAS Name: 3-hexyl-4-methyl-7-phenacyloxy-1-benzopyran-2-one IUPAC Name: 3-hexyl-4-methyl-7-phenacyloxychromen-2-one Traditional Name: 3-hexyl-4-methyl-7-phenacyloxy-coumarin Formula: C24H26O4 MolecularWeight: 378.46084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=CC=CC=C3)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=CC=CC=C3)OC1=O)C

InChI

InChI=1S/C24H26O4/c1-3-4-5-9-12-21-17(2)20-14-13-19(15-23(20)28-24(21)26)27-16-22(25)18-10-7-6-8-11-18/h6-8,10-11,13-15H,3-5,9,12,16H2,1-2H3