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4-(4-methyl-3-nitro-phenoxy)piperidine-1-carboxylic acid

4-(4-methyl-3-nitro-phenoxy)piperidine-1-carboxylic acid

Systemtic Name:4-(4-methyl-3-nitro-phenoxy)piperidine-1-carboxylic acid
Openeye Name:4-(4-methyl-3-nitro-phenoxy)piperidine-1-carboxylic acid
CAS Name:4-(4-methyl-3-nitrophenoxy)-1-piperidinecarboxylic acid
IUPAC Name:4-(4-methyl-3-nitrophenoxy)piperidine-1-carboxylic acid
Traditional Name:4-(4-methyl-3-nitro-phenoxy)piperidine-1-carboxylic acid
Formula: C13H16N2O5
MolecularWeight: 280.27654
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2CCN(CC2)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

CC1=C(C=C(C=C1)OC2CCN(CC2)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C13H16N2O5/c1-9-2-3-11(8-12(9)15(18)19)20-10-4-6-14(7-5-10)13(16)17/h2-3,8,10H,4-7H2,1H3,(H,16,17)


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