(phenylmethyl) N-[3-[4-[3-(1H-imidazol-5-yl)propanoylamino]butyl]oxiran-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[4-[3-(1H-imidazol-5-yl)propanoylamino]butyl]oxiran-2-yl]carbamate Openeye Name: benzyl N-[3-[4-[3-(1H-imidazol-5-yl)propanoylamino]butyl]oxiran-2-yl]carbamate CAS Name: N-[3-[4-[[3-(1H-imidazol-5-yl)-1-oxopropyl]amino]butyl]-2-oxiranyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[4-[3-(1H-imidazol-5-yl)propanoylamino]butyl]oxiran-2-yl]carbamate Traditional Name: N-[3-[4-[3-(1H-imidazol-5-yl)propanoylamino]butyl]oxiran-2-yl]carbamic acid benzyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2C(O2)CCCCNC(=O)CCC3=CN=CN3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2C(O2)CCCCNC(=O)CCC3=CN=CN3

InChI

InChI=1S/C20H26N4O4/c25-18(10-9-16-12-21-14-23-16)22-11-5-4-8-17-19(28-17)24-20(26)27-13-15-6-2-1-3-7-15/h1-3,6-7,12,14,17,19H,4-5,8-11,13H2,(H,21,23)(H,22,25)(H,24,26)