(phenylmethyl) N-[(2S)-1-oxidanylidene-6-(3-oxidanylidenebutanoylamino)-1-phenylazanyl-hexan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-oxidanylidene-6-(3-oxidanylidenebutanoylamino)-1-phenylazanyl-hexan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-5-(3-oxobutanoylamino)-1-(phenylcarbamoyl)pentyl]carbamate CAS Name: N-[(2S)-1-anilino-6-(1,3-dioxobutylamino)-1-oxohexan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-anilino-1-oxo-6-(3-oxobutanoylamino)hexan-2-yl]carbamate Traditional Name: N-[(1S)-5-(acetoacetylamino)-1-(phenylcarbamoyl)pentyl]carbamic acid benzyl ester Formula: C24H29N3O5 MolecularWeight: 439.50416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NCCCCC(C(=O)NC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC(=O)NCCCC[C@@H](C(=O)NC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H29N3O5/c1-18(28)16-22(29)25-15-9-8-14-21(23(30)26-20-12-6-3-7-13-20)27-24(31)32-17-19-10-4-2-5-11-19/h2-7,10-13,21H,8-9,14-17H2,1H3,(H,25,29)(H,26,30)(H,27,31)/t21-/m0/s1