[1-(1-heptoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-dodecoxybenzoate

Systemtic Name: [1-(1-heptoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-dodecoxybenzoate Openeye Name: [1-(1-heptoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-dodecoxybenzoate CAS Name: 4-dodecoxybenzoic acid [1-(1-heptoxyethyl)-4-phenyl-1-cyclohexa-2,5-dienyl] ester IUPAC Name: [1-(1-heptoxyethyl)-4-phenylcyclohexa-2,5-dien-1-yl] 4-dodecoxybenzoate Traditional Name: 4-lauryloxybenzoic acid [1-(1-heptoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] ester Formula: C40H58O4 MolecularWeight: 602.88612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)C(C)OCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)C(C)OCCCCCCC

InChI

InChI=1S/C40H58O4/c1-4-6-8-10-11-12-13-14-16-21-33-43-38-26-24-37(25-27-38)39(41)44-40(34(3)42-32-20-15-9-7-5-2)30-28-36(29-31-40)35-22-18-17-19-23-35/h17-19,22-31,34,36H,4-16,20-21,32-33H2,1-3H3