tert-butyl N-[3-(1H-imidazol-5-yl)-1-(octylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(1H-imidazol-5-yl)-1-(octylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(1H-imidazol-5-ylmethyl)-2-(octylamino)-2-oxo-ethyl]carbamate CAS Name: N-[3-(1H-imidazol-5-yl)-1-(octylamino)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(1H-imidazol-5-yl)-1-(octylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-(1H-imidazol-5-ylmethyl)-2-keto-2-(octylamino)ethyl]carbamic acid tert-butyl ester Formula: C19H34N4O3 MolecularWeight: 366.49826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C(CC1=CN=CN1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCNC(=O)C(CC1=CN=CN1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H34N4O3/c1-5-6-7-8-9-10-11-21-17(24)16(12-15-13-20-14-22-15)23-18(25)26-19(2,3)4/h13-14,16H,5-12H2,1-4H3,(H,20,22)(H,21,24)(H,23,25)