tert-butyl N-[1-(butylamino)-3-(4-cyanophenyl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(butylamino)-3-(4-cyanophenyl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-(butylamino)-1-[(4-cyanophenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[1-(butylamino)-3-(4-cyanophenyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(butylamino)-3-(4-cyanophenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-(butylamino)-1-(4-cyanobenzyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC1=CC=C(C=C1)C#N)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCNC(=O)C(CC1=CC=C(C=C1)C#N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H27N3O3/c1-5-6-11-21-17(23)16(22-18(24)25-19(2,3)4)12-14-7-9-15(13-20)10-8-14/h7-10,16H,5-6,11-12H2,1-4H3,(H,21,23)(H,22,24)