[2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] quinoxaline-6-carboxylate

Systemtic Name: [2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] quinoxaline-6-carboxylate Openeye Name: [2-(4-tert-butylanilino)-2-oxo-ethyl] quinoxaline-6-carboxylate CAS Name: 6-quinoxalinecarboxylic acid [2-(4-tert-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-tert-butylanilino)-2-oxoethyl] quinoxaline-6-carboxylate Traditional Name: quinoxaline-6-carboxylic acid [2-(4-tert-butylanilino)-2-keto-ethyl] ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC3=NC=CN=C3C=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC3=NC=CN=C3C=C2

InChI

InChI=1S/C21H21N3O3/c1-21(2,3)15-5-7-16(8-6-15)24-19(25)13-27-20(26)14-4-9-17-18(12-14)23-11-10-22-17/h4-12H,13H2,1-3H3,(H,24,25)