(phenylmethyl) N-[3-(4-carbamimidoylphenyl)-1-diphenoxyphosphoryl-propyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(4-carbamimidoylphenyl)-1-diphenoxyphosphoryl-propyl]carbamate Openeye Name: benzyl N-[3-(4-carbamimidoylphenyl)-1-diphenoxyphosphoryl-propyl]carbamate CAS Name: N-[3-(4-carbamimidoylphenyl)-1-diphenoxyphosphorylpropyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(4-carbamimidoylphenyl)-1-diphenoxyphosphorylpropyl]carbamate Traditional Name: N-[3-(4-amidinophenyl)-1-diphenoxyphosphoryl-propyl]carbamic acid benzyl ester Formula: C30H30N3O5P MolecularWeight: 543.550061

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCC2=CC=C(C=C2)C(=N)N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCC2=CC=C(C=C2)C(=N)N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C30H30N3O5P/c31-29(32)25-19-16-23(17-20-25)18-21-28(33-30(34)36-22-24-10-4-1-5-11-24)39(35,37-26-12-6-2-7-13-26)38-27-14-8-3-9-15-27/h1-17,19-20,28H,18,21-22H2,(H3,31,32)(H,33,34)