tert-butyl N-[2-oxidanyl-1-oxidanylidene-1-(1-phenylpropylamino)heptan-3-yl]carbamate

Systemtic Name: tert-butyl N-[2-oxidanyl-1-oxidanylidene-1-(1-phenylpropylamino)heptan-3-yl]carbamate Openeye Name: tert-butyl N-[1-[1-hydroxy-2-oxo-2-(1-phenylpropylamino)ethyl]pentyl]carbamate CAS Name: N-[2-hydroxy-1-oxo-1-(1-phenylpropylamino)heptan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-hydroxy-1-oxo-1-(1-phenylpropylamino)heptan-3-yl]carbamate Traditional Name: N-[1-[1-hydroxy-2-keto-2-(1-phenylpropylamino)ethyl]pentyl]carbamic acid tert-butyl ester Formula: C21H34N2O4 MolecularWeight: 378.50566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)NC(CC)C1=CC=CC=C1)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(C(=O)NC(CC)C1=CC=CC=C1)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H34N2O4/c1-6-8-14-17(23-20(26)27-21(3,4)5)18(24)19(25)22-16(7-2)15-12-10-9-11-13-15/h9-13,16-18,24H,6-8,14H2,1-5H3,(H,22,25)(H,23,26)