4-(4-methoxy-3-nitro-phenyl)sulfonyl-N-(3-methyl-2-morpholin-4-yl-butyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-methoxy-3-nitro-phenyl)sulfonyl-N-(3-methyl-2-morpholin-4-yl-butyl)piperazine-1-carboxamide Openeye Name: 4-(4-methoxy-3-nitro-phenyl)sulfonyl-N-(3-methyl-2-morpholino-butyl)piperazine-1-carboxamide CAS Name: 4-(4-methoxy-3-nitrophenyl)sulfonyl-N-[3-methyl-2-(4-morpholinyl)butyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-methoxy-3-nitrophenyl)sulfonyl-N-(3-methyl-2-morpholin-4-ylbutyl)piperazine-1-carboxamide Traditional Name: 4-(4-methoxy-3-nitro-phenyl)sulfonyl-N-(3-methyl-2-morpholino-butyl)piperazine-1-carboxamide Formula: C21H33N5O7S MolecularWeight: 499.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC(C)C(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C21H33N5O7S/c1-16(2)19(23-10-12-33-13-11-23)15-22-21(27)24-6-8-25(9-7-24)34(30,31)17-4-5-20(32-3)18(14-17)26(28)29/h4-5,14,16,19H,6-13,15H2,1-3H3,(H,22,27)