tert-butyl 2-[[2-methylpropylcarbamoyl(propanoyloxy)amino]methyl]-6-phenyl-hexanoate

Systemtic Name: tert-butyl 2-[[2-methylpropylcarbamoyl(propanoyloxy)amino]methyl]-6-phenyl-hexanoate Openeye Name: tert-butyl 2-[[isobutylcarbamoyl(propanoyloxy)amino]methyl]-6-phenyl-hexanoate CAS Name: 2-[[[(2-methylpropylamino)-oxomethyl]-(1-oxopropoxy)amino]methyl]-6-phenylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-methylpropylcarbamoyl(propanoyloxy)amino]methyl]-6-phenylhexanoate Traditional Name: 2-[[isobutylcarbamoyl(propionyloxy)amino]methyl]-6-phenyl-hexanoic acid tert-butyl ester Formula: C25H40N2O5 MolecularWeight: 448.5955

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON(CC(CCCCC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)NCC(C)C

Isomeric SMILES

CCC(=O)ON(CC(CCCCC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)NCC(C)C

InChI

InChI=1S/C25H40N2O5/c1-7-22(28)32-27(24(30)26-17-19(2)3)18-21(23(29)31-25(4,5)6)16-12-11-15-20-13-9-8-10-14-20/h8-10,13-14,19,21H,7,11-12,15-18H2,1-6H3,(H,26,30)