tert-butyl N-[(1S)-7-oxidanylidene-1-(5-quinoxalin-2-yl-1H-imidazol-2-yl)nonyl]carbamate

Systemtic Name: tert-butyl N-[(1S)-7-oxidanylidene-1-(5-quinoxalin-2-yl-1H-imidazol-2-yl)nonyl]carbamate Openeye Name: tert-butyl N-[(1S)-7-oxo-1-(5-quinoxalin-2-yl-1H-imidazol-2-yl)nonyl]carbamate CAS Name: N-[(1S)-7-oxo-1-[5-(2-quinoxalinyl)-1H-imidazol-2-yl]nonyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S)-7-oxo-1-(5-quinoxalin-2-yl-1H-imidazol-2-yl)nonyl]carbamate Traditional Name: N-[(1S)-7-keto-1-(5-quinoxalin-2-yl-1H-imidazol-2-yl)nonyl]carbamic acid tert-butyl ester Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CCCCCC(C1=NC=C(N1)C2=NC3=CC=CC=C3N=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(=O)CCCCC[C@@H](C1=NC=C(N1)C2=NC3=CC=CC=C3N=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H33N5O3/c1-5-17(31)11-7-6-8-14-20(30-24(32)33-25(2,3)4)23-27-16-22(29-23)21-15-26-18-12-9-10-13-19(18)28-21/h9-10,12-13,15-16,20H,5-8,11,14H2,1-4H3,(H,27,29)(H,30,32)/t20-/m0/s1