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

Systemtic Name: [1-[(2,4-dimethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-2-carboxylate Openeye Name: 1-[(2,4-dimethoxyphenyl)carbamoyl]propyl quinoxaline-2-carboxylate CAS Name: 2-quinoxalinecarboxylic acid [1-(2,4-dimethoxyanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,4-dimethoxyanilino)-1-oxobutan-2-yl] quinoxaline-2-carboxylate Traditional Name: quinoxaline-2-carboxylic acid 1-[(2,4-dimethoxyphenyl)carbamoyl]propyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O5/c1-4-18(20(25)24-16-10-9-13(27-2)11-19(16)28-3)29-21(26)17-12-22-14-7-5-6-8-15(14)23-17/h5-12,18H,4H2,1-3H3,(H,24,25)