ethyl 4-[4-[methylsulfonyl(prop-2-enyl)amino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[methylsulfonyl(prop-2-enyl)amino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[allyl(methylsulfonyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[methylsulfonyl(prop-2-enyl)amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[methylsulfonyl(prop-2-enyl)amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[allyl(mesyl)amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O5S/c1-4-10-21(27(3,24)25)16-8-6-15(7-9-16)17(22)19-11-13-20(14-12-19)18(23)26-5-2/h4,6-9H,1,5,10-14H2,2-3H3