(phenylmethyl) N-[N'-[(2R)-1-oxidanylbut-3-en-2-yl]-N-phenylmethoxycarbonyl-carbamimidoyl]carbamate

Systemtic Name: (phenylmethyl) N-[N'-[(2R)-1-oxidanylbut-3-en-2-yl]-N-phenylmethoxycarbonyl-carbamimidoyl]carbamate Openeye Name: benzyl N-[N-benzyloxycarbonyl-N'-[(1R)-1-(hydroxymethyl)allyl]carbamimidoyl]carbamate CAS Name: N-[[(2R)-1-hydroxybut-3-en-2-yl]imino-(phenylmethoxycarbonylamino)methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[N'-[(2R)-1-hydroxybut-3-en-2-yl]-N-phenylmethoxycarbonylcarbamimidoyl]carbamate Traditional Name: N-[N-carbobenzoxy-N'-[(1R)-1-methylolallyl]amidino]carbamic acid benzyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(CO)N=C(NC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C=C[C@H](CO)N=C(NC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23N3O5/c1-2-18(13-25)22-19(23-20(26)28-14-16-9-5-3-6-10-16)24-21(27)29-15-17-11-7-4-8-12-17/h2-12,18,25H,1,13-15H2,(H2,22,23,24,26,27)/t18-/m1/s1