ethyl 2-[(4-chloranyl-2-fluoranyl-5-phenylmethoxy-phenyl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 2-[(4-chloranyl-2-fluoranyl-5-phenylmethoxy-phenyl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: ethyl 2-[(5-benzyloxy-4-chloro-2-fluoro-phenyl)carbamoyl]cyclohexanecarboxylate CAS Name: 2-[(4-chloro-2-fluoro-5-phenylmethoxyanilino)-oxomethyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-2-fluoro-5-phenylmethoxyphenyl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: 2-[(5-benzoxy-4-chloro-2-fluoro-phenyl)carbamoyl]cyclohexanecarboxylic acid ethyl ester Formula: C23H25ClFNO4 MolecularWeight: 433.900303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCC1C(=O)NC2=CC(=C(C=C2F)Cl)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CCCCC1C(=O)NC2=CC(=C(C=C2F)Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C23H25ClFNO4/c1-2-29-23(28)17-11-7-6-10-16(17)22(27)26-20-13-21(18(24)12-19(20)25)30-14-15-8-4-3-5-9-15/h3-5,8-9,12-13,16-17H,2,6-7,10-11,14H2,1H3,(H,26,27)