butan-1-ol; 3-chloranyl-4-phenyl-benzoate

Systemtic Name: butan-1-ol; 3-chloranyl-4-phenyl-benzoate Openeye Name: butan-1-ol; 3-chloro-4-phenyl-benzoate CAS Name: 1-butanol; 3-chloro-4-phenylbenzoate IUPAC Name: butan-1-ol; 3-chloro-4-phenylbenzoate Traditional Name: butan-1-ol; 3-chloro-4-phenyl-benzoate Formula: C17H18ClO3- MolecularWeight: 305.77602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)[O-])Cl

Isomeric SMILES

CCCCO.C1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)[O-])Cl

InChI

InChI=1S/C13H9ClO2.C4H10O/c14-12-8-10(13(15)16)6-7-11(12)9-4-2-1-3-5-9;1-2-3-4-5/h1-8H,(H,15,16);5H,2-4H2,1H3/p-1