ethyl 1-[3-[(3-cyano-4,5-diphenyl-furan-2-yl)amino]quinoxalin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[(3-cyano-4,5-diphenyl-furan-2-yl)amino]quinoxalin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(3-cyano-4,5-diphenyl-2-furyl)amino]quinoxalin-2-yl]piperidine-4-carboxylate CAS Name: 1-[3-[(3-cyano-4,5-diphenyl-2-furanyl)amino]-2-quinoxalinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(3-cyano-4,5-diphenylfuran-2-yl)amino]quinoxalin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[(3-cyano-4,5-diphenyl-2-furyl)amino]quinoxalin-2-yl]isonipecotic acid ethyl ester Formula: C33H29N5O3 MolecularWeight: 543.61506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2NC4=C(C(=C(O4)C5=CC=CC=C5)C6=CC=CC=C6)C#N

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2NC4=C(C(=C(O4)C5=CC=CC=C5)C6=CC=CC=C6)C#N

InChI

InChI=1S/C33H29N5O3/c1-2-40-33(39)24-17-19-38(20-18-24)31-30(35-26-15-9-10-16-27(26)36-31)37-32-25(21-34)28(22-11-5-3-6-12-22)29(41-32)23-13-7-4-8-14-23/h3-16,24H,2,17-20H2,1H3,(H,35,37)