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

Systemtic Name: (3-nitrophenyl)methyl 4-morpholin-4-ylsulfonylbenzoate Openeye Name: (3-nitrophenyl)methyl 4-morpholinosulfonylbenzoate CAS Name: 4-(4-morpholinylsulfonyl)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-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=C(C=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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