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

Systemtic Name: tert-butyl N-[3-(4-cyanophenyl)-1-[methyl(octyl)amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(4-cyanophenyl)methyl]-2-[methyl(octyl)amino]-2-oxo-ethyl]carbamate CAS Name: N-[3-(4-cyanophenyl)-1-[methyl(octyl)amino]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(4-cyanophenyl)-1-[methyl(octyl)amino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-(4-cyanobenzyl)-2-keto-2-[methyl(octyl)amino]ethyl]carbamic acid tert-butyl ester Formula: C24H37N3O3 MolecularWeight: 415.56888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H37N3O3/c1-6-7-8-9-10-11-16-27(5)22(28)21(26-23(29)30-24(2,3)4)17-19-12-14-20(18-25)15-13-19/h12-15,21H,6-11,16-17H2,1-5H3,(H,26,29)