(4-phenyl-1-propyl-cyclohexa-2,5-dien-1-yl) 4-(1-octoxyethyl)benzoate

Systemtic Name: (4-phenyl-1-propyl-cyclohexa-2,5-dien-1-yl) 4-(1-octoxyethyl)benzoate Openeye Name: (4-phenyl-1-propyl-cyclohexa-2,5-dien-1-yl) 4-(1-octoxyethyl)benzoate CAS Name: 4-(1-octoxyethyl)benzoic acid (4-phenyl-1-propyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (4-phenyl-1-propylcyclohexa-2,5-dien-1-yl) 4-(1-octoxyethyl)benzoate Traditional Name: 4-(1-octoxyethyl)benzoic acid (4-phenyl-1-propyl-cyclohexa-2,5-dien-1-yl) ester Formula: C32H42O3 MolecularWeight: 474.67408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)CCC

Isomeric SMILES

CCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)CCC

InChI

InChI=1S/C32H42O3/c1-4-6-7-8-9-13-25-34-26(3)27-16-18-30(19-17-27)31(33)35-32(22-5-2)23-20-29(21-24-32)28-14-11-10-12-15-28/h10-12,14-21,23-24,26,29H,4-9,13,22,25H2,1-3H3