[4-(4-hexylcyclohexyl)cyclohexyl] 3-bromanyl-4-pentoxy-benzoate

Systemtic Name: [4-(4-hexylcyclohexyl)cyclohexyl] 3-bromanyl-4-pentoxy-benzoate Openeye Name: [4-(4-hexylcyclohexyl)cyclohexyl] 3-bromo-4-pentoxy-benzoate CAS Name: 3-bromo-4-pentoxybenzoic acid [4-(4-hexylcyclohexyl)cyclohexyl] ester IUPAC Name: [4-(4-hexylcyclohexyl)cyclohexyl] 3-bromo-4-pentoxybenzoate Traditional Name: 4-amoxy-3-bromo-benzoic acid [4-(4-hexylcyclohexyl)cyclohexyl] ester Formula: C30H47BrO3 MolecularWeight: 535.59638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCC)Br

Isomeric SMILES

CCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCC)Br

InChI

InChI=1S/C30H47BrO3/c1-3-5-7-8-10-23-11-13-24(14-12-23)25-15-18-27(19-16-25)34-30(32)26-17-20-29(28(31)22-26)33-21-9-6-4-2/h17,20,22-25,27H,3-16,18-19,21H2,1-2H3