pentan-3-yl N-[2-[2,5-bis(3-azanylpropylamino)pentanoylamino]ethyl]carbamate

Systemtic Name: pentan-3-yl N-[2-[2,5-bis(3-azanylpropylamino)pentanoylamino]ethyl]carbamate Openeye Name: 1-ethylpropyl N-[2-[2,5-bis(3-aminopropylamino)pentanoylamino]ethyl]carbamate CAS Name: N-[2-[[2,5-bis(3-aminopropylamino)-1-oxopentyl]amino]ethyl]carbamic acid pentan-3-yl ester IUPAC Name: pentan-3-yl N-[2-[2,5-bis(3-aminopropylamino)pentanoylamino]ethyl]carbamate Traditional Name: N-[2-[2,5-bis(3-aminopropylamino)pentanoylamino]ethyl]carbamic acid 1-ethylpropyl ester Formula: C19H42N6O3 MolecularWeight: 402.57518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC(=O)NCCNC(=O)C(CCCNCCCN)NCCCN

Isomeric SMILES

CCC(CC)OC(=O)NCCNC(=O)C(CCCNCCCN)NCCCN

InChI

InChI=1S/C19H42N6O3/c1-3-16(4-2)28-19(27)25-15-14-24-18(26)17(23-13-7-10-21)8-5-11-22-12-6-9-20/h16-17,22-23H,3-15,20-21H2,1-2H3,(H,24,26)(H,25,27)