5-(2-chloranyl-4-phenyl-phenoxy)pentanoate

Systemtic Name: 5-(2-chloranyl-4-phenyl-phenoxy)pentanoate Openeye Name: 5-(2-chloro-4-phenyl-phenoxy)pentanoate CAS Name: 5-(2-chloro-4-phenylphenoxy)pentanoate IUPAC Name: 5-(2-chloro-4-phenylphenoxy)pentanoate Traditional Name: 5-(2-chloro-4-phenyl-phenoxy)valerate Formula: C17H16ClO3- MolecularWeight: 303.76014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClO3/c18-15-12-14(13-6-2-1-3-7-13)9-10-16(15)21-11-5-4-8-17(19)20/h1-3,6-7,9-10,12H,4-5,8,11H2,(H,19,20)/p-1