(5-methyl-2-nitro-phenyl) 4-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (5-methyl-2-nitro-phenyl) 4-morpholin-4-ylsulfonylbenzoate Openeye Name: (5-methyl-2-nitro-phenyl) 4-morpholinosulfonylbenzoate CAS Name: 4-(4-morpholinylsulfonyl)benzoic acid (5-methyl-2-nitrophenyl) ester IUPAC Name: (5-methyl-2-nitrophenyl) 4-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-morpholinosulfonylbenzoic acid (5-methyl-2-nitro-phenyl) ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O7S/c1-13-2-7-16(20(22)23)17(12-13)27-18(21)14-3-5-15(6-4-14)28(24,25)19-8-10-26-11-9-19/h2-7,12H,8-11H2,1H3