ethyl 5-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonyl-amino]pentanoate

Systemtic Name: ethyl 5-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonyl-amino]pentanoate Openeye Name: ethyl 5-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonyl-amino]pentanoate CAS Name: 5-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonylamino]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonylamino]pentanoate Traditional Name: 5-[(2-fluorobenzyl)-nosyl-amino]valeric acid ethyl ester Formula: C20H23FN2O6S MolecularWeight: 438.469823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN(CC1=CC=CC=C1F)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCCN(CC1=CC=CC=C1F)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23FN2O6S/c1-2-29-20(24)9-5-6-14-22(15-16-7-3-4-8-19(16)21)30(27,28)18-12-10-17(11-13-18)23(25)26/h3-4,7-8,10-13H,2,5-6,9,14-15H2,1H3