[5-(4-undec-10-enoxyphenyl)pyrazin-2-yl] 2-azanyl-4-(2-fluoranylhexanoyloxy)-5-nitro-benzoate

Systemtic Name: [5-(4-undec-10-enoxyphenyl)pyrazin-2-yl] 2-azanyl-4-(2-fluoranylhexanoyloxy)-5-nitro-benzoate Openeye Name: [5-(4-undec-10-enoxyphenyl)pyrazin-2-yl] 2-amino-4-(2-fluorohexanoyloxy)-5-nitro-benzoate CAS Name: 2-amino-4-(2-fluoro-1-oxohexoxy)-5-nitrobenzoic acid [5-(4-undec-10-enoxyphenyl)-2-pyrazinyl] ester IUPAC Name: [5-(4-undec-10-enoxyphenyl)pyrazin-2-yl] 2-amino-4-(2-fluorohexanoyloxy)-5-nitrobenzoate Traditional Name: 2-amino-4-(2-fluorohexanoyloxy)-5-nitro-benzoic acid [5-(4-undec-10-enoxyphenyl)pyrazin-2-yl] ester Formula: C34H41FN4O7 MolecularWeight: 636.710343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC1=C(C=C(C(=C1)N)C(=O)OC2=NC=C(N=C2)C3=CC=C(C=C3)OCCCCCCCCCC=C)[N+](=O)[O-])F

Isomeric SMILES

CCCCC(C(=O)OC1=C(C=C(C(=C1)N)C(=O)OC2=NC=C(N=C2)C3=CC=C(C=C3)OCCCCCCCCCC=C)[N+](=O)[O-])F

InChI

InChI=1S/C34H41FN4O7/c1-3-5-7-8-9-10-11-12-13-19-44-25-17-15-24(16-18-25)29-22-38-32(23-37-29)46-33(40)26-20-30(39(42)43)31(21-28(26)36)45-34(41)27(35)14-6-4-2/h3,15-18,20-23,27H,1,4-14,19,36H2,2H3