3,8-bis(phenylmethoxycarbonylamino)octanoate

Systemtic Name: 3,8-bis(phenylmethoxycarbonylamino)octanoate Openeye Name: 3,8-bis(benzyloxycarbonylamino)octanoate CAS Name: 3,8-bis(phenylmethoxycarbonylamino)octanoate IUPAC Name: 3,8-bis(phenylmethoxycarbonylamino)octanoate Traditional Name: 3,8-bis(benzyloxycarbonylamino)caprylate Formula: C24H29N2O6- MolecularWeight: 441.49686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCCC(CC(=O)[O-])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCCC(CC(=O)[O-])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O6/c27-22(28)16-21(26-24(30)32-18-20-12-6-2-7-13-20)14-8-3-9-15-25-23(29)31-17-19-10-4-1-5-11-19/h1-2,4-7,10-13,21H,3,8-9,14-18H2,(H,25,29)(H,26,30)(H,27,28)/p-1