2-(2-phenylethanoylamino)ethyl 6-azanyl-6-fluoranyl-5-(2-oxidanylpropyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 2-(2-phenylethanoylamino)ethyl 6-azanyl-6-fluoranyl-5-(2-oxidanylpropyl)cyclohexa-2,4-diene-1-carboxylate Openeye Name: 2-[(2-phenylacetyl)amino]ethyl 6-amino-6-fluoro-5-(2-hydroxypropyl)cyclohexa-2,4-diene-1-carboxylate CAS Name: 6-amino-6-fluoro-5-(2-hydroxypropyl)-1-cyclohexa-2,4-dienecarboxylic acid 2-[(1-oxo-2-phenylethyl)amino]ethyl ester IUPAC Name: 2-[(2-phenylacetyl)amino]ethyl 6-amino-6-fluoro-5-(2-hydroxypropyl)cyclohexa-2,4-diene-1-carboxylate Traditional Name: 6-amino-6-fluoro-5-(2-hydroxypropyl)cyclohexa-2,4-diene-1-carboxylic acid 2-[(2-phenylacetyl)amino]ethyl ester Formula: C20H25FN2O4 MolecularWeight: 376.421903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC(C1(N)F)C(=O)OCCNC(=O)CC2=CC=CC=C2)O

Isomeric SMILES

CC(CC1=CC=CC(C1(N)F)C(=O)OCCNC(=O)CC2=CC=CC=C2)O

InChI

InChI=1S/C20H25FN2O4/c1-14(24)12-16-8-5-9-17(20(16,21)22)19(26)27-11-10-23-18(25)13-15-6-3-2-4-7-15/h2-9,14,17,24H,10-13,22H2,1H3,(H,23,25)