(4S,5S)-5-(benzotriazol-1-yl)-5-ethenyl-nonan-4-ol

Systemtic Name: (4S,5S)-5-(benzotriazol-1-yl)-5-ethenyl-nonan-4-ol Openeye Name: (4S,5S)-5-(benzotriazol-1-yl)-5-vinyl-nonan-4-ol CAS Name: (4S,5S)-5-(1-benzotriazolyl)-5-ethenyl-4-nonanol IUPAC Name: (4S,5S)-5-(benzotriazol-1-yl)-5-ethenylnonan-4-ol Traditional Name: (3S,4S)-3-(benzotriazol-1-yl)-3-butyl-hept-1-en-4-ol Formula: C17H25N3O MolecularWeight: 287.3999

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=C)(C(CCC)O)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CCCC[C@](C=C)([C@H](CCC)O)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C17H25N3O/c1-4-7-13-17(6-3,16(21)10-5-2)20-15-12-9-8-11-14(15)18-19-20/h6,8-9,11-12,16,21H,3-5,7,10,13H2,1-2H3/t16-,17+/m0/s1