(E)-6-(benzotriazol-1-yl)-6-ethoxy-hexadec-4-en-7-one

Systemtic Name: (E)-6-(benzotriazol-1-yl)-6-ethoxy-hexadec-4-en-7-one Openeye Name: (E)-6-(benzotriazol-1-yl)-6-ethoxy-hexadec-4-en-7-one CAS Name: (E)-6-(1-benzotriazolyl)-6-ethoxy-4-hexadecen-7-one IUPAC Name: (E)-6-(benzotriazol-1-yl)-6-ethoxyhexadec-4-en-7-one Traditional Name: (E)-6-(benzotriazol-1-yl)-6-ethoxy-hexadec-4-en-7-one Formula: C24H37N3O2 MolecularWeight: 399.56948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)C(C=CCCC)(N1C2=CC=CC=C2N=N1)OCC

Isomeric SMILES

CCCCCCCCCC(=O)C(/C=C/CCC)(N1C2=CC=CC=C2N=N1)OCC

InChI

InChI=1S/C24H37N3O2/c1-4-7-9-10-11-12-13-19-23(28)24(29-6-3,20-16-8-5-2)27-22-18-15-14-17-21(22)25-26-27/h14-18,20H,4-13,19H2,1-3H3/b20-16+