(1-butoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-decoxyethyl)benzoate

Systemtic Name: (1-butoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-decoxyethyl)benzoate Openeye Name: (1-butoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-decoxyethyl)benzoate CAS Name: 4-(1-decoxyethyl)benzoic acid (1-butoxy-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-butoxy-4-phenylcyclohexa-2,5-dien-1-yl) 4-(1-decoxyethyl)benzoate Traditional Name: 4-(1-decoxyethyl)benzoic acid (1-butoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C35H48O4 MolecularWeight: 532.75322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)OCCCC

Isomeric SMILES

CCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)OCCCC

InChI

InChI=1S/C35H48O4/c1-4-6-8-9-10-11-12-16-27-37-29(3)30-19-21-33(22-20-30)34(36)39-35(38-28-7-5-2)25-23-32(24-26-35)31-17-14-13-15-18-31/h13-15,17-26,29,32H,4-12,16,27-28H2,1-3H3