[2-[(5-tert-butyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl] 2,3-dimethylquinoline-4-carboxylate

Systemtic Name: [2-[(5-tert-butyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl] 2,3-dimethylquinoline-4-carboxylate Openeye Name: [2-(5-tert-butyl-2-methoxy-anilino)-2-oxo-ethyl] 2,3-dimethylquinoline-4-carboxylate CAS Name: 2,3-dimethyl-4-quinolinecarboxylic acid [2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-tert-butyl-2-methoxyanilino)-2-oxoethyl] 2,3-dimethylquinoline-4-carboxylate Traditional Name: 2,3-dimethylcinchoninic acid [2-(5-tert-butyl-2-methoxy-anilino)-2-keto-ethyl] ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C)C(=O)OCC(=O)NC3=C(C=CC(=C3)C(C)(C)C)OC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C)C(=O)OCC(=O)NC3=C(C=CC(=C3)C(C)(C)C)OC

InChI

InChI=1S/C25H28N2O4/c1-15-16(2)26-19-10-8-7-9-18(19)23(15)24(29)31-14-22(28)27-20-13-17(25(3,4)5)11-12-21(20)30-6/h7-13H,14H2,1-6H3,(H,27,28)