2-(4-chlorophenyl)-2-cyano-3-methyl-3-phenoxy-butanoate

Systemtic Name: 2-(4-chlorophenyl)-2-cyano-3-methyl-3-phenoxy-butanoate Openeye Name: 2-(4-chlorophenyl)-2-cyano-3-methyl-3-phenoxy-butanoate CAS Name: 2-(4-chlorophenyl)-2-cyano-3-methyl-3-phenoxybutanoate IUPAC Name: 2-(4-chlorophenyl)-2-cyano-3-methyl-3-phenoxybutanoate Traditional Name: 2-(4-chlorophenyl)-2-cyano-3-methyl-3-phenoxy-butyrate Formula: C18H15ClNO3- MolecularWeight: 328.7696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C#N)(C1=CC=C(C=C1)Cl)C(=O)[O-])OC2=CC=CC=C2

Isomeric SMILES

CC(C)(C(C#N)(C1=CC=C(C=C1)Cl)C(=O)[O-])OC2=CC=CC=C2

InChI

InChI=1S/C18H16ClNO3/c1-17(2,23-15-6-4-3-5-7-15)18(12-20,16(21)22)13-8-10-14(19)11-9-13/h3-11H,1-2H3,(H,21,22)/p-1