methyl 2-(5-nitro-2-piperidin-1-yl-phenyl)ethanoate

Systemtic Name: methyl 2-(5-nitro-2-piperidin-1-yl-phenyl)ethanoate Openeye Name: methyl 2-[5-nitro-2-(1-piperidyl)phenyl]acetate CAS Name: 2-[5-nitro-2-(1-piperidinyl)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-(5-nitro-2-piperidin-1-ylphenyl)acetate Traditional Name: 2-(5-nitro-2-piperidino-phenyl)acetic acid methyl ester Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

COC(=O)CC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCCC2

InChI

InChI=1S/C14H18N2O4/c1-20-14(17)10-11-9-12(16(18)19)5-6-13(11)15-7-3-2-4-8-15/h5-6,9H,2-4,7-8,10H2,1H3