4-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethylamino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethylamino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethylamino]-3-nitro-benzonitrile CAS Name: 4-[2-[(2,6-dimethyl-4-morpholinyl)sulfonyl]ethylamino]-3-nitrobenzonitrile IUPAC Name: 4-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethylamino]-3-nitrobenzonitrile Traditional Name: 4-[2-(2,6-dimethylmorpholino)sulfonylethylamino]-3-nitro-benzonitrile Formula: C15H20N4O5S MolecularWeight: 368.4081

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C15H20N4O5S/c1-11-9-18(10-12(2)24-11)25(22,23)6-5-17-14-4-3-13(8-16)7-15(14)19(20)21/h3-4,7,11-12,17H,5-6,9-10H2,1-2H3