4-[4-[3-(3,5-dimethylphenoxy)propoxy]-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-[3-(3,5-dimethylphenoxy)propoxy]-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-[3-(3,5-dimethylphenoxy)propoxy]-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[3-(3,5-dimethylphenoxy)propoxy]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-[3-(3,5-dimethylphenoxy)propoxy]-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-[3-(3,5-dimethylphenoxy)propoxy]-3-nitro-phenyl]sulfonylmorpholine Formula: C21H26N2O7S MolecularWeight: 450.50534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCOC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCOC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C

InChI

InChI=1S/C21H26N2O7S/c1-16-12-17(2)14-18(13-16)29-8-3-9-30-21-5-4-19(15-20(21)23(24)25)31(26,27)22-6-10-28-11-7-22/h4-5,12-15H,3,6-11H2,1-2H3