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

Systemtic Name: [1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-2-carboxylate Openeye Name: 1-[(2-ethoxyphenyl)carbamoyl]propyl quinoxaline-2-carboxylate CAS Name: 2-quinoxalinecarboxylic acid [1-(2-ethoxyanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2-ethoxyanilino)-1-oxobutan-2-yl] quinoxaline-2-carboxylate Traditional Name: quinoxaline-2-carboxylic acid 1-(o-phenetylcarbamoyl)propyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1OCC)OC(=O)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1OCC)OC(=O)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C21H21N3O4/c1-3-18(20(25)24-16-11-7-8-12-19(16)27-4-2)28-21(26)17-13-22-14-9-5-6-10-15(14)23-17/h5-13,18H,3-4H2,1-2H3,(H,24,25)