1-phenyl-7-(prop-1-ynylamino)heptane-3,4,5-triol

Systemtic Name: 1-phenyl-7-(prop-1-ynylamino)heptane-3,4,5-triol Openeye Name: 1-phenyl-7-(prop-1-ynylamino)heptane-3,4,5-triol CAS Name: 1-phenyl-7-(prop-1-ynylamino)heptane-3,4,5-triol IUPAC Name: 1-phenyl-7-(prop-1-ynylamino)heptane-3,4,5-triol Traditional Name: 1-phenyl-7-(prop-1-ynylamino)heptane-3,4,5-triol Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC#CNCCC(C(C(CCC1=CC=CC=C1)O)O)O

Isomeric SMILES

CC#CNCCC(C(C(CCC1=CC=CC=C1)O)O)O

InChI

InChI=1S/C16H23NO3/c1-2-11-17-12-10-15(19)16(20)14(18)9-8-13-6-4-3-5-7-13/h3-7,14-20H,8-10,12H2,1H3