ethyl 4-[2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[N-(benzenesulfonyl)-4-nitro-anilino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[N-(benzenesulfonyl)-4-nitroanilino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[N-(benzenesulfonyl)-4-nitroanilino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(N-besyl-4-nitro-anilino)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H24N4O7S MolecularWeight: 476.50286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O7S/c1-2-32-21(27)23-14-12-22(13-15-23)20(26)16-24(17-8-10-18(11-9-17)25(28)29)33(30,31)19-6-4-3-5-7-19/h3-11H,2,12-16H2,1H3