ethyl 3-[(4-acetamidophenyl)sulfonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(4-acetamidophenyl)sulfonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[(4-acetamidophenyl)sulfonyl-benzyl-amino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(4-acetamidophenyl)sulfonyl-benzylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonyl-benzyl-amino]propionic acid ethyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O5S/c1-3-27-20(24)13-14-22(15-17-7-5-4-6-8-17)28(25,26)19-11-9-18(10-12-19)21-16(2)23/h4-12H,3,13-15H2,1-2H3,(H,21,23)