1-[(E,1R,4R)-4-(benzotriazol-1-yl)-1,4-dimethoxy-but-2-enyl]benzotriazole

Systemtic Name: 1-[(E,1R,4R)-4-(benzotriazol-1-yl)-1,4-dimethoxy-but-2-enyl]benzotriazole Openeye Name: 1-[(E,1R,4R)-4-(benzotriazol-1-yl)-1,4-dimethoxy-but-2-enyl]benzotriazole CAS Name: 1-[(E,1R,4R)-4-(1-benzotriazolyl)-1,4-dimethoxybut-2-enyl]benzotriazole IUPAC Name: 1-[(E,1R,4R)-4-(benzotriazol-1-yl)-1,4-dimethoxybut-2-enyl]benzotriazole Traditional Name: 1-[(E,1R,4R)-4-(benzotriazol-1-yl)-1,4-dimethoxy-but-2-enyl]benzotriazole Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

COC(C=CC(N1C2=CC=CC=C2N=N1)OC)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CO[C@H](/C=C/[C@H](N1C2=CC=CC=C2N=N1)OC)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H18N6O2/c1-25-17(23-15-9-5-3-7-13(15)19-21-23)11-12-18(26-2)24-16-10-6-4-8-14(16)20-22-24/h3-12,17-18H,1-2H3/b12-11+/t17-,18-/m1/s1