3,5-bis[3-(phenylmethoxycarbonylamino)propoxy]benzoic acid

Systemtic Name: 3,5-bis[3-(phenylmethoxycarbonylamino)propoxy]benzoic acid Openeye Name: 3,5-bis[3-(benzyloxycarbonylamino)propoxy]benzoic acid CAS Name: 3,5-bis[3-(phenylmethoxycarbonylamino)propoxy]benzoic acid IUPAC Name: 3,5-bis[3-(phenylmethoxycarbonylamino)propoxy]benzoic acid Traditional Name: 3,5-bis[3-(benzyloxycarbonylamino)propoxy]benzoic acid Formula: C29H32N2O8 MolecularWeight: 536.57298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCOC2=CC(=CC(=C2)C(=O)O)OCCCNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCOC2=CC(=CC(=C2)C(=O)O)OCCCNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H32N2O8/c32-27(33)24-17-25(36-15-7-13-30-28(34)38-20-22-9-3-1-4-10-22)19-26(18-24)37-16-8-14-31-29(35)39-21-23-11-5-2-6-12-23/h1-6,9-12,17-19H,7-8,13-16,20-21H2,(H,30,34)(H,31,35)(H,32,33)