[(2R)-2-(hydroxymethyl)-7-(phenylmethoxycarbonylamino)heptyl] ethanoate

Systemtic Name: [(2R)-2-(hydroxymethyl)-7-(phenylmethoxycarbonylamino)heptyl] ethanoate Openeye Name: [(2R)-7-(benzyloxycarbonylamino)-2-(hydroxymethyl)heptyl] acetate CAS Name: acetic acid [(2R)-2-(hydroxymethyl)-7-(phenylmethoxycarbonylamino)heptyl] ester IUPAC Name: [(2R)-2-(hydroxymethyl)-7-(phenylmethoxycarbonylamino)heptyl] acetate Traditional Name: acetic acid [(2R)-7-(benzyloxycarbonylamino)-2-methylol-heptyl] ester Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CCCCCNC(=O)OCC1=CC=CC=C1)CO

Isomeric SMILES

CC(=O)OC[C@H](CCCCCNC(=O)OCC1=CC=CC=C1)CO

InChI

InChI=1S/C18H27NO5/c1-15(21)23-14-17(12-20)10-6-3-7-11-19-18(22)24-13-16-8-4-2-5-9-16/h2,4-5,8-9,17,20H,3,6-7,10-14H2,1H3,(H,19,22)/t17-/m1/s1