N-cyclopropyl-4-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-4-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-3-nitro-benzamide Openeye Name: N-cyclopropyl-4-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-3-nitro-benzamide CAS Name: N-cyclopropyl-4-[4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]-1-piperazinyl]-3-nitrobenzamide IUPAC Name: N-cyclopropyl-4-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-3-nitrobenzamide Traditional Name: N-cyclopropyl-4-[4-(2,6-dimethylmorpholino)sulfonylpiperazino]-3-nitro-benzamide Formula: C20H29N5O6S MolecularWeight: 467.53916

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C20H29N5O6S/c1-14-12-24(13-15(2)31-14)32(29,30)23-9-7-22(8-10-23)18-6-3-16(11-19(18)25(27)28)20(26)21-17-4-5-17/h3,6,11,14-15,17H,4-5,7-10,12-13H2,1-2H3,(H,21,26)