4-[3-[(4-methylphenyl)sulfonylmethyl]-4-nitro-phenyl]morpholine

Systemtic Name: 4-[3-[(4-methylphenyl)sulfonylmethyl]-4-nitro-phenyl]morpholine Openeye Name: 4-[4-nitro-3-(p-tolylsulfonylmethyl)phenyl]morpholine CAS Name: 4-[3-[(4-methylphenyl)sulfonylmethyl]-4-nitrophenyl]morpholine IUPAC Name: 4-[3-[(4-methylphenyl)sulfonylmethyl]-4-nitrophenyl]morpholine Traditional Name: 4-[4-nitro-3-(tosylmethyl)phenyl]morpholine Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O5S/c1-14-2-5-17(6-3-14)26(23,24)13-15-12-16(4-7-18(15)20(21)22)19-8-10-25-11-9-19/h2-7,12H,8-11,13H2,1H3