ethyl (2S)-1-(2-azanyl-4-chloranyl-5-methyl-phenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S)-1-(2-azanyl-4-chloranyl-5-methyl-phenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: ethyl (2S)-1-(2-amino-4-chloro-5-methyl-phenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-amino-4-chloro-5-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-1-(2-amino-4-chloro-5-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-amino-4-chloro-5-methyl-phenyl)sulfonylpyrrolidine-2-carboxylic acid ethyl ester Formula: C14H19ClN2O4S MolecularWeight: 346.82966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN1S(=O)(=O)C2=C(C=C(C(=C2)C)Cl)N

Isomeric SMILES

CCOC(=O)[C@@H]1CCCN1S(=O)(=O)C2=C(C=C(C(=C2)C)Cl)N

InChI

InChI=1S/C14H19ClN2O4S/c1-3-21-14(18)12-5-4-6-17(12)22(19,20)13-7-9(2)10(15)8-11(13)16/h7-8,12H,3-6,16H2,1-2H3/t12-/m0/s1