1-(2-oxidanyl-5-phenylmethoxy-phenyl)heptan-1-one

Systemtic Name: 1-(2-oxidanyl-5-phenylmethoxy-phenyl)heptan-1-one Openeye Name: 1-(5-benzyloxy-2-hydroxy-phenyl)heptan-1-one CAS Name: 1-(2-hydroxy-5-phenylmethoxyphenyl)-1-heptanone IUPAC Name: 1-(2-hydroxy-5-phenylmethoxyphenyl)heptan-1-one Traditional Name: 1-(5-benzoxy-2-hydroxy-phenyl)heptan-1-one Formula: C20H24O3 MolecularWeight: 312.40276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=C(C=CC(=C1)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCC(=O)C1=C(C=CC(=C1)OCC2=CC=CC=C2)O

InChI

InChI=1S/C20H24O3/c1-2-3-4-8-11-19(21)18-14-17(12-13-20(18)22)23-15-16-9-6-5-7-10-16/h5-7,9-10,12-14,22H,2-4,8,11,15H2,1H3