(phenylmethyl) (2S)-2-(6-azanylhexanoylamino)hexanoate

Systemtic Name: (phenylmethyl) (2S)-2-(6-azanylhexanoylamino)hexanoate Openeye Name: benzyl (2S)-2-(6-aminohexanoylamino)hexanoate CAS Name: (2S)-2-[(6-amino-1-oxohexyl)amino]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(6-aminohexanoylamino)hexanoate Traditional Name: (2S)-2-(6-aminohexanoylamino)hexanoic acid benzyl ester Formula: C19H30N2O3 MolecularWeight: 334.4531

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC1=CC=CC=C1)NC(=O)CCCCCN

Isomeric SMILES

CCCC[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)CCCCCN

InChI

InChI=1S/C19H30N2O3/c1-2-3-12-17(21-18(22)13-8-5-9-14-20)19(23)24-15-16-10-6-4-7-11-16/h4,6-7,10-11,17H,2-3,5,8-9,12-15,20H2,1H3,(H,21,22)/t17-/m0/s1