(phenylmethyl) N-[1-oxidanylidene-1-[[(E)-5-oxidanylpent-2-enyl]amino]-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-oxidanylidene-1-[[(E)-5-oxidanylpent-2-enyl]amino]-3-phenyl-propan-2-yl]carbamate Openeye Name: benzyl N-[1-benzyl-2-[[(E)-5-hydroxypent-2-enyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[1-[[(E)-5-hydroxypent-2-enyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[[(E)-5-hydroxypent-2-enyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[[(E)-5-hydroxypent-2-enyl]amino]-2-keto-ethyl]carbamic acid benzyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC=CCCO)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC/C=C/CCO)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4/c25-15-9-3-8-14-23-21(26)20(16-18-10-4-1-5-11-18)24-22(27)28-17-19-12-6-2-7-13-19/h1-8,10-13,20,25H,9,14-17H2,(H,23,26)(H,24,27)/b8-3+