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(3-nitrophenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate

(3-nitrophenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name:(3-nitrophenyl)methyl 3-nitro-4-piperidin-1-yl-benzoate
Openeye Name:(3-nitrophenyl)methyl 3-nitro-4-(1-piperidyl)benzoate
CAS Name:3-nitro-4-(1-piperidinyl)benzoic acid (3-nitrophenyl)methyl ester
IUPAC Name:(3-nitrophenyl)methyl 3-nitro-4-piperidin-1-ylbenzoate
Traditional Name:3-nitro-4-piperidino-benzoic acid (3-nitrobenzyl) ester
Formula: C19H19N3O6
MolecularWeight: 385.37066
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C19H19N3O6/c23-19(28-13-14-5-4-6-16(11-14)21(24)25)15-7-8-17(18(12-15)22(26)27)20-9-2-1-3-10-20/h4-8,11-12H,1-3,9-10,13H2


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