ethyl 3-[(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-amino]propanoate CAS Name: 3-[(4-chloro-2,5-dimethylphenyl)sulfonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-(4-chloro-2,5-dimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[benzyl-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-amino]propionic acid ethyl ester Formula: C20H24ClNO4S MolecularWeight: 409.92686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=C(C=C(C(=C2)C)Cl)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=C(C=C(C(=C2)C)Cl)C

InChI

InChI=1S/C20H24ClNO4S/c1-4-26-20(23)10-11-22(14-17-8-6-5-7-9-17)27(24,25)19-13-15(2)18(21)12-16(19)3/h5-9,12-13H,4,10-11,14H2,1-3H3