tert-butyl N-butyl-N-[2-(phenylmethoxycarbonylaminomethyl)heptanoylamino]carbamate

Systemtic Name: tert-butyl N-butyl-N-[2-(phenylmethoxycarbonylaminomethyl)heptanoylamino]carbamate Openeye Name: tert-butyl N-[2-(benzyloxycarbonylaminomethyl)heptanoylamino]-N-butyl-carbamate CAS Name: N-butyl-N-[[1-oxo-2-(phenylmethoxycarbonylaminomethyl)heptyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-butyl-N-[2-(phenylmethoxycarbonylaminomethyl)heptanoylamino]carbamate Traditional Name: N-[2-(benzyloxycarbonylaminomethyl)heptanoylamino]-N-butyl-carbamic acid tert-butyl ester Formula: C25H41N3O5 MolecularWeight: 463.61014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CNC(=O)OCC1=CC=CC=C1)C(=O)NN(CCCC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC(CNC(=O)OCC1=CC=CC=C1)C(=O)NN(CCCC)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H41N3O5/c1-6-8-11-16-21(18-26-23(30)32-19-20-14-12-10-13-15-20)22(29)27-28(17-9-7-2)24(31)33-25(3,4)5/h10,12-15,21H,6-9,11,16-19H2,1-5H3,(H,26,30)(H,27,29)