(1-butyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-methoxyethyl)benzoate

Systemtic Name: (1-butyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-methoxyethyl)benzoate Openeye Name: (1-butyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-methoxyethyl)benzoate CAS Name: 4-(1-methoxyethyl)benzoic acid (1-butyl-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-butyl-4-phenylcyclohexa-2,5-dien-1-yl) 4-(1-methoxyethyl)benzoate Traditional Name: 4-(1-methoxyethyl)benzoic acid (1-butyl-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C26H30O3 MolecularWeight: 390.5146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(C)OC

Isomeric SMILES

CCCCC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(C)OC

InChI

InChI=1S/C26H30O3/c1-4-5-17-26(18-15-23(16-19-26)22-9-7-6-8-10-22)29-25(27)24-13-11-21(12-14-24)20(2)28-3/h6-16,18-20,23H,4-5,17H2,1-3H3