[4-[2-(4-pentylcyclohexyl)ethyl]phenyl] 2-azanyl-4-(2-fluoranyl-3-methyl-pentanoyl)oxy-5-nitro-benzoate

Systemtic Name: [4-[2-(4-pentylcyclohexyl)ethyl]phenyl] 2-azanyl-4-(2-fluoranyl-3-methyl-pentanoyl)oxy-5-nitro-benzoate Openeye Name: [4-[2-(4-pentylcyclohexyl)ethyl]phenyl] 2-amino-4-(2-fluoro-3-methyl-pentanoyl)oxy-5-nitro-benzoate CAS Name: 2-amino-4-(2-fluoro-3-methyl-1-oxopentoxy)-5-nitrobenzoic acid [4-[2-(4-pentylcyclohexyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(4-pentylcyclohexyl)ethyl]phenyl] 2-amino-4-(2-fluoro-3-methylpentanoyl)oxy-5-nitrobenzoate Traditional Name: 2-amino-4-(2-fluoro-3-methyl-pentanoyl)oxy-5-nitro-benzoic acid [4-[2-(4-amylcyclohexyl)ethyl]phenyl] ester Formula: C32H43FN2O6 MolecularWeight: 570.692023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3N)OC(=O)C(C(C)CC)F)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3N)OC(=O)C(C(C)CC)F)[N+](=O)[O-]

InChI

InChI=1S/C32H43FN2O6/c1-4-6-7-8-22-9-11-23(12-10-22)13-14-24-15-17-25(18-16-24)40-31(36)26-19-28(35(38)39)29(20-27(26)34)41-32(37)30(33)21(3)5-2/h15-23,30H,4-14,34H2,1-3H3