N-[[3-(benzotriazol-2-yl)-5-octyl-2-oxidanyl-phenyl]methyl]-2-methyl-prop-2-enamide

Systemtic Name: N-[[3-(benzotriazol-2-yl)-5-octyl-2-oxidanyl-phenyl]methyl]-2-methyl-prop-2-enamide Openeye Name: N-[[3-(benzotriazol-2-yl)-2-hydroxy-5-octyl-phenyl]methyl]-2-methyl-prop-2-enamide CAS Name: N-[[3-(2-benzotriazolyl)-2-hydroxy-5-octylphenyl]methyl]-2-methyl-2-propenamide IUPAC Name: N-[[3-(benzotriazol-2-yl)-2-hydroxy-5-octylphenyl]methyl]-2-methylprop-2-enamide Traditional Name: N-[3-(benzotriazol-2-yl)-2-hydroxy-5-octyl-benzyl]-2-methyl-acrylamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)CNC(=O)C(=C)C

Isomeric SMILES

CCCCCCCCC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)CNC(=O)C(=C)C

InChI

InChI=1S/C25H32N4O2/c1-4-5-6-7-8-9-12-19-15-20(17-26-25(31)18(2)3)24(30)23(16-19)29-27-21-13-10-11-14-22(21)28-29/h10-11,13-16,30H,2,4-9,12,17H2,1,3H3,(H,26,31)