hept-6-en-2-yl 4-phenylmethoxybenzoate

Systemtic Name: hept-6-en-2-yl 4-phenylmethoxybenzoate Openeye Name: 1-methylhex-5-enyl 4-benzyloxybenzoate CAS Name: 4-phenylmethoxybenzoic acid hept-6-en-2-yl ester IUPAC Name: hept-6-en-2-yl 4-phenylmethoxybenzoate Traditional Name: 4-benzoxybenzoic acid 1-methylhex-5-enyl ester Formula: C21H24O3 MolecularWeight: 324.41346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC=C)OC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(CCCC=C)OC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24O3/c1-3-4-6-9-17(2)24-21(22)19-12-14-20(15-13-19)23-16-18-10-7-5-8-11-18/h3,5,7-8,10-15,17H,1,4,6,9,16H2,2H3