(1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-butoxyethyl)benzoate

Systemtic Name: (1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-butoxyethyl)benzoate Openeye Name: (1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-butoxyethyl)benzoate CAS Name: 4-(1-butoxyethyl)benzoic acid (1-nonyl-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-nonyl-4-phenylcyclohexa-2,5-dien-1-yl) 4-(1-butoxyethyl)benzoate Traditional Name: 4-(1-butoxyethyl)benzoic acid (1-nonyl-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C34H46O3 MolecularWeight: 502.72724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCC

Isomeric SMILES

CCCCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCC

InChI

InChI=1S/C34H46O3/c1-4-6-8-9-10-11-15-24-34(25-22-31(23-26-34)30-16-13-12-14-17-30)37-33(35)32-20-18-29(19-21-32)28(3)36-27-7-5-2/h12-14,16-23,25-26,28,31H,4-11,15,24,27H2,1-3H3