phenyl 3-chloranyl-4-pentoxy-benzoate

Systemtic Name: phenyl 3-chloranyl-4-pentoxy-benzoate Openeye Name: phenyl 3-chloro-4-pentoxy-benzoate CAS Name: 3-chloro-4-pentoxybenzoic acid phenyl ester IUPAC Name: phenyl 3-chloro-4-pentoxybenzoate Traditional Name: 4-amoxy-3-chloro-benzoic acid phenyl ester Formula: C18H19ClO3 MolecularWeight: 318.79466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClO3/c1-2-3-7-12-21-17-11-10-14(13-16(17)19)18(20)22-15-8-5-4-6-9-15/h4-6,8-11,13H,2-3,7,12H2,1H3