2-methylbutyl 4-[4-(6-prop-2-enoxyhexoxy)phenyl]benzoate

Systemtic Name: 2-methylbutyl 4-[4-(6-prop-2-enoxyhexoxy)phenyl]benzoate Openeye Name: 2-methylbutyl 4-[4-(6-allyloxyhexoxy)phenyl]benzoate CAS Name: 4-[4-(6-prop-2-enoxyhexoxy)phenyl]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 4-[4-(6-prop-2-enoxyhexoxy)phenyl]benzoate Traditional Name: 4-[4-(6-allyloxyhexoxy)phenyl]benzoic acid 2-methylbutyl ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OCCCCCCOCC=C

Isomeric SMILES

CCC(C)COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OCCCCCCOCC=C

InChI

InChI=1S/C27H36O4/c1-4-18-29-19-8-6-7-9-20-30-26-16-14-24(15-17-26)23-10-12-25(13-11-23)27(28)31-21-22(3)5-2/h4,10-17,22H,1,5-9,18-21H2,2-3H3