ethyl 4-[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-[benzyl(methylsulfonyl)amino]phenoxy]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-[benzyl(methylsulfonyl)amino]phenoxy]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-[benzyl(mesyl)amino]phenoxy]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H29N3O6S/c1-3-31-23(28)25-15-13-24(14-16-25)22(27)18-32-21-11-9-20(10-12-21)26(33(2,29)30)17-19-7-5-4-6-8-19/h4-12H,3,13-18H2,1-2H3