[4-[(4-pentylcyclohexyl)methoxy]phenyl] 2-azanyl-4-(2-fluoranylhexanoyloxy)-5-nitro-benzoate

Systemtic Name: [4-[(4-pentylcyclohexyl)methoxy]phenyl] 2-azanyl-4-(2-fluoranylhexanoyloxy)-5-nitro-benzoate Openeye Name: [4-[(4-pentylcyclohexyl)methoxy]phenyl] 2-amino-4-(2-fluorohexanoyloxy)-5-nitro-benzoate CAS Name: 2-amino-4-(2-fluoro-1-oxohexoxy)-5-nitrobenzoic acid [4-[(4-pentylcyclohexyl)methoxy]phenyl] ester IUPAC Name: [4-[(4-pentylcyclohexyl)methoxy]phenyl] 2-amino-4-(2-fluorohexanoyloxy)-5-nitrobenzoate Traditional Name: 2-amino-4-(2-fluorohexanoyloxy)-5-nitro-benzoic acid [4-[(4-amylcyclohexyl)methoxy]phenyl] ester Formula: C31H41FN2O7 MolecularWeight: 572.664843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)COC2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3N)OC(=O)C(CCCC)F)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1CCC(CC1)COC2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3N)OC(=O)C(CCCC)F)[N+](=O)[O-]

InChI

InChI=1S/C31H41FN2O7/c1-3-5-7-8-21-10-12-22(13-11-21)20-39-23-14-16-24(17-15-23)40-30(35)25-18-28(34(37)38)29(19-27(25)33)41-31(36)26(32)9-6-4-2/h14-19,21-22,26H,3-13,20,33H2,1-2H3