1-(cyclohexen-1-yl)-2-(phenylmethoxymethoxy)heptan-1-one

Systemtic Name: 1-(cyclohexen-1-yl)-2-(phenylmethoxymethoxy)heptan-1-one Openeye Name: 2-(benzyloxymethoxy)-1-(cyclohexen-1-yl)heptan-1-one CAS Name: 1-(1-cyclohexenyl)-2-(phenylmethoxymethoxy)-1-heptanone IUPAC Name: 1-(cyclohexen-1-yl)-2-(phenylmethoxymethoxy)heptan-1-one Traditional Name: 2-(benzoxymethoxy)-1-(cyclohexen-1-yl)heptan-1-one Formula: C21H30O3 MolecularWeight: 330.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)C1=CCCCC1)OCOCC2=CC=CC=C2

Isomeric SMILES

CCCCCC(C(=O)C1=CCCCC1)OCOCC2=CC=CC=C2

InChI

InChI=1S/C21H30O3/c1-2-3-6-15-20(21(22)19-13-9-5-10-14-19)24-17-23-16-18-11-7-4-8-12-18/h4,7-8,11-13,20H,2-3,5-6,9-10,14-17H2,1H3