[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-5-carboxylate

Systemtic Name: [1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-5-carboxylate Openeye Name: 1-[(4-ethoxyphenyl)carbamoyl]propyl quinoxaline-5-carboxylate CAS Name: 5-quinoxalinecarboxylic acid [1-(4-ethoxyanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-ethoxyanilino)-1-oxobutan-2-yl] quinoxaline-5-carboxylate Traditional Name: quinoxaline-5-carboxylic acid 1-(p-phenetylcarbamoyl)propyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OCC)OC(=O)C2=C3C(=CC=C2)N=CC=N3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OCC)OC(=O)C2=C3C(=CC=C2)N=CC=N3

InChI

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