(2-nitrophenyl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-benzoate

Systemtic Name: (2-nitrophenyl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-benzoate Openeye Name: (2-nitrophenyl)methyl 5-morpholinosulfonyl-2-(1-piperidyl)benzoate CAS Name: 5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)benzoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-ylbenzoate Traditional Name: 5-morpholinosulfonyl-2-piperidino-benzoic acid (2-nitrobenzyl) ester Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O7S/c27-23(33-17-18-6-2-3-7-21(18)26(28)29)20-16-19(34(30,31)25-12-14-32-15-13-25)8-9-22(20)24-10-4-1-5-11-24/h2-3,6-9,16H,1,4-5,10-15,17H2