2-[[4-(2-chloroethyloxy)phenyl]methyl]-4-phenyl-butanoate

Systemtic Name: 2-[[4-(2-chloroethyloxy)phenyl]methyl]-4-phenyl-butanoate Openeye Name: 2-[[4-(2-chloroethoxy)phenyl]methyl]-4-phenyl-butanoate CAS Name: 2-[[4-(2-chloroethoxy)phenyl]methyl]-4-phenylbutanoate IUPAC Name: 2-[[4-(2-chloroethoxy)phenyl]methyl]-4-phenylbutanoate Traditional Name: 2-[4-(2-chloroethoxy)benzyl]-4-phenyl-butyrate Formula: C19H20ClO3- MolecularWeight: 331.8133

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CC2=CC=C(C=C2)OCCCl)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC(CC2=CC=C(C=C2)OCCCl)C(=O)[O-]

InChI

InChI=1S/C19H21ClO3/c20-12-13-23-18-10-7-16(8-11-18)14-17(19(21)22)9-6-15-4-2-1-3-5-15/h1-5,7-8,10-11,17H,6,9,12-14H2,(H,21,22)/p-1