phenyl 4-pentoxybenzoate

Systemtic Name: phenyl 4-pentoxybenzoate Openeye Name: phenyl 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid phenyl ester IUPAC Name: phenyl 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid phenyl ester Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H20O3/c1-2-3-7-14-20-16-12-10-15(11-13-16)18(19)21-17-8-5-4-6-9-17/h4-6,8-13H,2-3,7,14H2,1H3