[2-[4-(phenylmethoxycarbonylamino)butanoyloxy]-3-phosphonooxy-propyl] hexanoate

Systemtic Name: [2-[4-(phenylmethoxycarbonylamino)butanoyloxy]-3-phosphonooxy-propyl] hexanoate Openeye Name: [2-[4-(benzyloxycarbonylamino)butanoyloxy]-3-phosphonooxy-propyl] hexanoate CAS Name: hexanoic acid [2-[1-oxo-4-(phenylmethoxycarbonylamino)butoxy]-3-phosphonooxypropyl] ester IUPAC Name: [2-[4-(phenylmethoxycarbonylamino)butanoyloxy]-3-phosphonooxypropyl] hexanoate Traditional Name: hexanoic acid [2-[4-(benzyloxycarbonylamino)butanoyloxy]-3-phosphonooxy-propyl] ester Formula: C21H32NO10P MolecularWeight: 489.453241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H32NO10P/c1-2-3-5-11-19(23)29-15-18(16-31-33(26,27)28)32-20(24)12-8-13-22-21(25)30-14-17-9-6-4-7-10-17/h4,6-7,9-10,18H,2-3,5,8,11-16H2,1H3,(H,22,25)(H2,26,27,28)