3-(4-fluoranylphenoxy)propyl 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: 3-(4-fluorophenoxy)propyl 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid 3-(4-fluorophenoxy)propyl ester Formula: C21H23FN2O5 MolecularWeight: 402.416123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCCCOC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCCCOC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C21H23FN2O5/c22-17-6-8-18(9-7-17)28-13-4-14-29-21(25)16-5-10-19(20(15-16)24(26)27)23-11-2-1-3-12-23/h5-10,15H,1-4,11-14H2