(E)-6-(benzotriazol-1-yl)-6-ethoxy-2-methyl-3-propan-2-yl-hex-5-en-3-ol

Systemtic Name: (E)-6-(benzotriazol-1-yl)-6-ethoxy-2-methyl-3-propan-2-yl-hex-5-en-3-ol Openeye Name: (E)-6-(benzotriazol-1-yl)-6-ethoxy-3-isopropyl-2-methyl-hex-5-en-3-ol CAS Name: (E)-6-(1-benzotriazolyl)-6-ethoxy-2-methyl-3-propan-2-yl-5-hexen-3-ol IUPAC Name: (E)-6-(benzotriazol-1-yl)-6-ethoxy-2-methyl-3-propan-2-ylhex-5-en-3-ol Traditional Name: (E)-6-(benzotriazol-1-yl)-6-ethoxy-3-isopropyl-2-methyl-hex-5-en-3-ol Formula: C18H27N3O2 MolecularWeight: 317.42588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCO/C(=C/CC(C(C)C)(C(C)C)O)/N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C18H27N3O2/c1-6-23-17(11-12-18(22,13(2)3)14(4)5)21-16-10-8-7-9-15(16)19-20-21/h7-11,13-14,22H,6,12H2,1-5H3/b17-11+