3-(chloromethyl)-3-octoxy-6-phenyl-cyclohexa-1,4-diene

Systemtic Name: 3-(chloromethyl)-3-octoxy-6-phenyl-cyclohexa-1,4-diene Openeye Name: 3-(chloromethyl)-3-octoxy-6-phenyl-cyclohexa-1,4-diene CAS Name: 3-(chloromethyl)-3-octoxy-6-phenylcyclohexa-1,4-diene IUPAC Name: 3-(chloromethyl)-3-octoxy-6-phenylcyclohexa-1,4-diene Traditional Name: 3-(chloromethyl)-3-octoxy-6-phenyl-cyclohexa-1,4-diene Formula: C21H29ClO MolecularWeight: 332.90736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)CCl

Isomeric SMILES

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)CCl

InChI

InChI=1S/C21H29ClO/c1-2-3-4-5-6-10-17-23-21(18-22)15-13-20(14-16-21)19-11-8-7-9-12-19/h7-9,11-16,20H,2-6,10,17-18H2,1H3