3-dec-9-enoxycarbonyloxy-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-dec-9-enoxycarbonyloxy-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-dec-9-enoxycarbonyloxy-propanoic acid CAS Name: 3-[dec-9-enoxy(oxo)methoxy]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-dec-9-enoxycarbonyloxy-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-dec-9-enoxycarbonyloxy-propionic acid Formula: C22H31NO7 MolecularWeight: 421.48404

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCOC(=O)OCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

C=CCCCCCCCCOC(=O)OCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C22H31NO7/c1-2-3-4-5-6-7-8-12-15-28-22(27)30-17-19(20(24)25)23-21(26)29-16-18-13-10-9-11-14-18/h2,9-11,13-14,19H,1,3-8,12,15-17H2,(H,23,26)(H,24,25)