[1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: [1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: 1-[(4-fluorophenyl)carbamoyl]propyl 6-methyl-4-oxo-chromene-2-carboxylate CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [1-(4-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-fluoroanilino)-1-oxobutan-2-yl] 6-methyl-4-oxochromene-2-carboxylate Traditional Name: 4-keto-6-methyl-chromene-2-carboxylic acid 1-[(4-fluorophenyl)carbamoyl]propyl ester Formula: C21H18FNO5 MolecularWeight: 383.369723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)C

InChI

InChI=1S/C21H18FNO5/c1-3-17(20(25)23-14-7-5-13(22)6-8-14)28-21(26)19-11-16(24)15-10-12(2)4-9-18(15)27-19/h4-11,17H,3H2,1-2H3,(H,23,25)