ethyl 4-[2-[methylsulfonyl(phenyl)amino]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[methylsulfonyl(phenyl)amino]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(N-methylsulfonylanilino)propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-(N-methylsulfonylanilino)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(N-methylsulfonylanilino)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(N-mesylanilino)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H25N3O5S MolecularWeight: 383.4625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H25N3O5S/c1-4-25-17(22)19-12-10-18(11-13-19)16(21)14(2)20(26(3,23)24)15-8-6-5-7-9-15/h5-9,14H,4,10-13H2,1-3H3