(phenylmethyl) N-[3-[4-(3-methylbutanoylamino)butyl]oxiran-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[4-(3-methylbutanoylamino)butyl]oxiran-2-yl]carbamate Openeye Name: benzyl N-[3-[4-(3-methylbutanoylamino)butyl]oxiran-2-yl]carbamate CAS Name: N-[3-[4-[(3-methyl-1-oxobutyl)amino]butyl]-2-oxiranyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[4-(3-methylbutanoylamino)butyl]oxiran-2-yl]carbamate Traditional Name: N-[3-[4-(isovalerylamino)butyl]oxiran-2-yl]carbamic acid benzyl ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCCCCC1C(O1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)NCCCCC1C(O1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H28N2O4/c1-14(2)12-17(22)20-11-7-6-10-16-18(25-16)21-19(23)24-13-15-8-4-3-5-9-15/h3-5,8-9,14,16,18H,6-7,10-13H2,1-2H3,(H,20,22)(H,21,23)