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

Systemtic Name: (phenylmethyl) N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]carbamate Openeye Name: benzyl N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]carbamate CAS Name: N-[3-[4-[(3-cyano-1-oxopropyl)amino]butyl]-2-oxiranyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]carbamate Traditional Name: N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]carbamic acid benzyl ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2C(O2)CCCCNC(=O)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2C(O2)CCCCNC(=O)CCC#N

InChI

InChI=1S/C18H23N3O4/c19-11-6-10-16(22)20-12-5-4-9-15-17(25-15)21-18(23)24-13-14-7-2-1-3-8-14/h1-3,7-8,15,17H,4-6,9-10,12-13H2,(H,20,22)(H,21,23)