ethyl 4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazine-1-carboxylate CAS Name: 4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazine-1-carboxylate Traditional Name: 4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazine-1-carboxylic acid ethyl ester Formula: C17H24N4O7S MolecularWeight: 428.46006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H24N4O7S/c1-2-28-17(22)19-7-5-18(6-8-19)15-4-3-14(13-16(15)21(23)24)29(25,26)20-9-11-27-12-10-20/h3-4,13H,2,5-12H2,1H3