ethyl 1-[4-[[8-azanyl-3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]amino]phenyl]carbonylpiperidine-2-carboxylate

Systemtic Name: ethyl 1-[4-[[8-azanyl-3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]amino]phenyl]carbonylpiperidine-2-carboxylate Openeye Name: ethyl 1-[4-[[8-amino-3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]amino]benzoyl]piperidine-2-carboxylate CAS Name: 1-[[4-[[8-amino-3-phenyl-6-(trifluoromethyl)-2-quinoxalinyl]amino]phenyl]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[8-amino-3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]amino]benzoyl]piperidine-2-carboxylate Traditional Name: 1-[4-[[8-amino-3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]amino]benzoyl]pipecolinic acid ethyl ester Formula: C30H28F3N5O3 MolecularWeight: 563.57023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C2=CC=C(C=C2)NC3=NC4=C(C=C(C=C4N)C(F)(F)F)N=C3C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)C2=CC=C(C=C2)NC3=NC4=C(C=C(C=C4N)C(F)(F)F)N=C3C5=CC=CC=C5

InChI

InChI=1S/C30H28F3N5O3/c1-2-41-29(40)24-10-6-7-15-38(24)28(39)19-11-13-21(14-12-19)35-27-25(18-8-4-3-5-9-18)36-23-17-20(30(31,32)33)16-22(34)26(23)37-27/h3-5,8-9,11-14,16-17,24H,2,6-7,10,15,34H2,1H3,(H,35,37)