tert-butyl 3-[phenylmethoxycarbonyl-[4-(phenylmethoxycarbonylamino)butyl]amino]propanoate

Systemtic Name: tert-butyl 3-[phenylmethoxycarbonyl-[4-(phenylmethoxycarbonylamino)butyl]amino]propanoate Openeye Name: tert-butyl 3-[benzyloxycarbonyl-[4-(benzyloxycarbonylamino)butyl]amino]propanoate CAS Name: 3-[phenylmethoxycarbonyl-[4-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[phenylmethoxycarbonyl-[4-(phenylmethoxycarbonylamino)butyl]amino]propanoate Traditional Name: 3-[4-(benzyloxycarbonylamino)butyl-carbobenzoxy-amino]propionic acid tert-butyl ester Formula: C27H36N2O6 MolecularWeight: 484.58454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCN(CCCCNC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CCN(CCCCNC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C27H36N2O6/c1-27(2,3)35-24(30)16-19-29(26(32)34-21-23-14-8-5-9-15-23)18-11-10-17-28-25(31)33-20-22-12-6-4-7-13-22/h4-9,12-15H,10-11,16-21H2,1-3H3,(H,28,31)