(E,2S,3R)-2-azanyl-13-(4-iodophenyl)tridec-4-ene-1,3-diol

Systemtic Name: (E,2S,3R)-2-azanyl-13-(4-iodophenyl)tridec-4-ene-1,3-diol Openeye Name: (E,2S,3R)-2-amino-13-(4-iodophenyl)tridec-4-ene-1,3-diol CAS Name: (E,2S,3R)-2-amino-13-(4-iodophenyl)-4-tridecene-1,3-diol IUPAC Name: (E,2S,3R)-2-amino-13-(4-iodophenyl)tridec-4-ene-1,3-diol Traditional Name: (E,2S,3R)-2-amino-13-(4-iodophenyl)tridec-4-ene-1,3-diol Formula: C19H30INO2 MolecularWeight: 431.35147

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCCCCC=CC(C(CO)N)O)I

Isomeric SMILES

C1=CC(=CC=C1CCCCCCCC/C=C/[C@H]([C@H](CO)N)O)I

InChI

InChI=1S/C19H30INO2/c20-17-13-11-16(12-14-17)9-7-5-3-1-2-4-6-8-10-19(23)18(21)15-22/h8,10-14,18-19,22-23H,1-7,9,15,21H2/b10-8+/t18-,19+/m0/s1