ethyl 3-[(3-chloranyl-2-methyl-phenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]propanoate

Systemtic Name: ethyl 3-[(3-chloranyl-2-methyl-phenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]propanoate Openeye Name: ethyl 3-[(3-chloro-2-methyl-phenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]propanoate CAS Name: 3-[(3-chloro-2-methylphenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3-chloro-2-methylphenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]propanoate Traditional Name: 3-[(3-chloro-2-methyl-phenyl)sulfonyl-(2-fluorobenzyl)amino]propionic acid ethyl ester Formula: C19H21ClFNO4S MolecularWeight: 413.890743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1F)S(=O)(=O)C2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1F)S(=O)(=O)C2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C19H21ClFNO4S/c1-3-26-19(23)11-12-22(13-15-7-4-5-9-17(15)21)27(24,25)18-10-6-8-16(20)14(18)2/h4-10H,3,11-13H2,1-2H3