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

Systemtic Name: [1-[(4-ethoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] quinoxaline-5-carboxylate Openeye Name: 1-[(4-ethoxycarbonylphenyl)carbamoyl]propyl quinoxaline-5-carboxylate CAS Name: 5-quinoxalinecarboxylic acid [1-(4-ethoxycarbonylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-ethoxycarbonylanilino)-1-oxobutan-2-yl] quinoxaline-5-carboxylate Traditional Name: quinoxaline-5-carboxylic acid 1-[(4-carbethoxyphenyl)carbamoyl]propyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O5/c1-3-18(20(26)25-15-10-8-14(9-11-15)21(27)29-4-2)30-22(28)16-6-5-7-17-19(16)24-13-12-23-17/h5-13,18H,3-4H2,1-2H3,(H,25,26)