phenyl 4-butyl-2-oxidanyl-benzoate

Systemtic Name: phenyl 4-butyl-2-oxidanyl-benzoate Openeye Name: phenyl 4-butyl-2-hydroxy-benzoate CAS Name: 4-butyl-2-hydroxybenzoic acid phenyl ester IUPAC Name: phenyl 4-butyl-2-hydroxybenzoate Traditional Name: 4-butyl-2-hydroxy-benzoic acid phenyl ester Formula: C17H18O3 MolecularWeight: 270.32302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)O

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)O

InChI

InChI=1S/C17H18O3/c1-2-3-7-13-10-11-15(16(18)12-13)17(19)20-14-8-5-4-6-9-14/h4-6,8-12,18H,2-3,7H2,1H3