(2-methoxy-5-nitro-phenyl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-(2,6-dimethylmorpholino)sulfonylbenzoic acid (2-methoxy-5-nitro-benzyl) ester Formula: C21H24N2O8S MolecularWeight: 464.48886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24N2O8S/c1-14-11-22(12-15(2)31-14)32(27,28)19-7-4-16(5-8-19)21(24)30-13-17-10-18(23(25)26)6-9-20(17)29-3/h4-10,14-15H,11-13H2,1-3H3