(3-nitrophenyl)methyl 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (3-nitrophenyl)methyl 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (3-nitrophenyl)methyl 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (3-nitrobenzyl) ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O7S/c21-18(27-13-14-3-1-5-16(11-14)20(22)23)15-4-2-6-17(12-15)28(24,25)19-7-9-26-10-8-19/h1-6,11-12H,7-10,13H2