[1-[(4-iodophenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-2-carboxylate

Systemtic Name: [1-[(4-iodophenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-2-carboxylate Openeye Name: 1-[(4-iodophenyl)carbamoyl]propyl quinoxaline-2-carboxylate CAS Name: 2-quinoxalinecarboxylic acid [1-(4-iodoanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-iodoanilino)-1-oxobutan-2-yl] quinoxaline-2-carboxylate Traditional Name: quinoxaline-2-carboxylic acid 1-[(4-iodophenyl)carbamoyl]propyl ester Formula: C19H16IN3O3 MolecularWeight: 461.25311

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)I)OC(=O)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)I)OC(=O)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C19H16IN3O3/c1-2-17(18(24)22-13-9-7-12(20)8-10-13)26-19(25)16-11-21-14-5-3-4-6-15(14)23-16/h3-11,17H,2H2,1H3,(H,22,24)