[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)cyclobutane-1-carboxylate

Systemtic Name: [2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)cyclobutane-1-carboxylate Openeye Name: [2-[(3-fluoro-4-methyl-phenyl)methylamino]-2-oxo-ethyl] 1-(4-chlorophenyl)cyclobutanecarboxylate CAS Name: 1-(4-chlorophenyl)-1-cyclobutanecarboxylic acid [2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl] 1-(4-chlorophenyl)cyclobutane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)cyclobutanecarboxylic acid [2-[(3-fluoro-4-methyl-benzyl)amino]-2-keto-ethyl] ester Formula: C21H21ClFNO3 MolecularWeight: 389.847743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)COC(=O)C2(CCC2)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)COC(=O)C2(CCC2)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C21H21ClFNO3/c1-14-3-4-15(11-18(14)23)12-24-19(25)13-27-20(26)21(9-2-10-21)16-5-7-17(22)8-6-16/h3-8,11H,2,9-10,12-13H2,1H3,(H,24,25)