tert-butyl 4-[2-[(4-ethoxyphenyl)amino]pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(4-ethoxyphenyl)amino]pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-ethoxyanilino)pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(4-ethoxyanilino)-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-ethoxyanilino)pyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(p-phenetidino)nicotinoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H30N4O4/c1-5-30-18-10-8-17(9-11-18)25-20-19(7-6-12-24-20)21(28)26-13-15-27(16-14-26)22(29)31-23(2,3)4/h6-12H,5,13-16H2,1-4H3,(H,24,25)