[1-[(2,3-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-5-carboxylate

Systemtic Name: [1-[(2,3-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-5-carboxylate Openeye Name: 1-[(2,3-dimethylphenyl)carbamoyl]propyl quinoxaline-5-carboxylate CAS Name: 5-quinoxalinecarboxylic acid [1-(2,3-dimethylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,3-dimethylanilino)-1-oxobutan-2-yl] quinoxaline-5-carboxylate Traditional Name: quinoxaline-5-carboxylic acid 1-[(2,3-dimethylphenyl)carbamoyl]propyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1C)C)OC(=O)C2=C3C(=CC=C2)N=CC=N3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1C)C)OC(=O)C2=C3C(=CC=C2)N=CC=N3

InChI

InChI=1S/C21H21N3O3/c1-4-18(20(25)24-16-9-5-7-13(2)14(16)3)27-21(26)15-8-6-10-17-19(15)23-12-11-22-17/h5-12,18H,4H2,1-3H3,(H,24,25)