(phenylmethyl) 2-[2-azanyl-3-(4-phenylmethoxyphenyl)propanoyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-azanyl-3-(4-phenylmethoxyphenyl)propanoyl]piperazine-1-carboxylate Openeye Name: benzyl 2-[2-amino-3-(4-benzyloxyphenyl)propanoyl]piperazine-1-carboxylate CAS Name: 2-[2-amino-1-oxo-3-(4-phenylmethoxyphenyl)propyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-amino-3-(4-phenylmethoxyphenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 2-[2-amino-3-(4-benzoxyphenyl)propanoyl]piperazine-1-carboxylic acid benzyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(C(CN1)C(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O4/c29-25(17-21-11-13-24(14-12-21)34-19-22-7-3-1-4-8-22)27(32)26-18-30-15-16-31(26)28(33)35-20-23-9-5-2-6-10-23/h1-14,25-26,30H,15-20,29H2